data_2lpn_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 2lpn _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo . . . . . 0 N--CA 1.45 -1.084 0 N-CA-C 110.807 -0.497 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.972 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -70.09 -50.83 26.2 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.544 -172.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.884 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -174.1 -91.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -169.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -134.75 -80.7 0.44 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB3' ' H ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -71.14 -88.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.38 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 36.9 tt0 -163.64 -77.83 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.553 0 O-C-N 122.315 -0.24 . . . . 0.0 110.563 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.794 HG13 HD22 ' A' ' 55' ' ' LEU . 46.6 t -56.95 -40.36 71.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.666 ' HA ' HD23 ' A' ' 55' ' ' LEU . 35.8 t -59.78 -40.68 89.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.085 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.701 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 15.2 ptpt -75.97 -42.54 48.09 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.624 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 4.7 mm-40 -65.74 -40.9 92.6 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.006 -176.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -62.15 -54.82 35.72 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.62 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 95.5 mt -57.84 -52.74 64.21 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 122.957 0.161 . . . . 0.0 110.772 -177.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.972 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -60.14 -51.3 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 123.125 0.266 . . . . 0.0 111.391 -176.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 20' ' ' ARG . 23.4 mtm180 -67.58 -39.37 84.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.218 -175.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -64.2 -41.76 96.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 122.086 0.946 . . . . 0.0 109.667 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.709 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 14.5 t80 -64.81 -55.7 18.04 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.722 -173.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -76.16 -19.33 58.56 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.998 -176.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 t -64.59 -55.19 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.013 174.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.616 ' HA ' HG12 ' A' ' 30' ' ' VAL . 3.4 mp -59.74 -40.32 87.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.508 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 22' ' ' TYR . 51.4 mm -64.27 -43.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -74.82 -43.74 53.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.461 -177.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.776 ' HB2' HG13 ' A' ' 30' ' ' VAL . 16.2 mtm180 -67.79 -14.38 62.91 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.007 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.19 28.4 66.33 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.776 HG13 ' HB2' ' A' ' 28' ' ' ARG . 3.4 p -111.93 51.81 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 CA-C-O 122.761 1.267 . . . . 0.0 109.27 -175.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.473 ' CG ' ' H ' ' A' ' 32' ' ' PHE . 9.2 t-20 -145.09 -167.32 2.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.318 -177.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.473 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 95.8 m-85 68.67 4.59 4.45 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.575 0.75 . . . . 0.0 111.139 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.515 ' O ' HG13 ' A' ' 37' ' ' ILE . 15.5 m -128.47 107.35 9.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.255 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.064 -173.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -68.72 -32.75 72.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.238 0.542 . . . . 0.0 110.492 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.468 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 55.3 m -73.11 -42.16 63.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 33' ' ' SER . 53.7 mt -59.27 -32.97 49.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.25 0.547 . . . . 0.0 109.543 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -68.43 -44.16 75.56 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.526 ' HA ' HD13 ' A' ' 42' ' ' ILE . 47.5 tptt -69.91 -39.06 76.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.682 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.82 -28.31 62.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.904 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.39 -46.87 82.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 168.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.526 HD13 ' HA ' ' A' ' 39' ' ' LYS . 82.5 mt -56.06 -52.11 54.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 176.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.5 m -57.14 -55.66 31.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.714 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.88 -39.4 83.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.084 -173.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 56.9 m -62.93 -39.35 94.32 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.35 -29.4 24.51 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.494 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -92.23 58.71 3.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.709 0.766 . . . . 0.0 110.582 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.98 -164.94 1.98 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.295 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -98.11 167.33 10.95 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.398 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.99 -40.14 19.7 Favored Glycine 0 C--N 1.333 0.382 0 O-C-N 123.839 0.712 . . . . 0.0 114.298 -170.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.573 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 5.0 mptp? -51.86 -48.48 63.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.919 0.39 . . . . 0.0 111.221 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -82.99 -35.44 25.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.198 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 2.9 m120 -62.59 -33.95 76.0 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 23.5 tpt180 -83.42 -38.96 21.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.851 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.794 HD22 HG13 ' A' ' 13' ' ' VAL . 19.7 tp -55.34 -39.53 70.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.316 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.76 -23.05 65.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.557 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 45.6 m-85 -61.78 -27.15 68.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.614 176.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.446 ' HB3' HG12 ' A' ' 97' ' ' ILE . 62.0 m-85 -86.33 -19.96 29.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.85 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.7 mt -102.2 -22.5 14.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.365 -174.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 124.73 -128.56 6.76 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.205 -0.522 . . . . 0.0 111.822 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.714 ' H ' ' HG ' ' A' ' 70' ' ' LEU . . . 57.24 -167.72 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 112.201 175.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 58.3 p 56.68 11.04 0.8 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.085 0.954 . . . . 0.0 112.922 177.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt 60.8 13.98 4.81 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.879 0.472 . . . . 0.0 111.467 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.409 ' HB3' ' H ' ' A' ' 65' ' ' ALA . 3.4 m-20 -151.28 -161.65 1.38 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.088 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.409 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . 70.94 -84.03 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 O-C-N 123.817 0.698 . . . . 0.0 111.38 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.02 104.48 5.25 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.92 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.5 p -83.84 -26.31 29.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -77.09 -47.28 20.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.029 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.1 tt -64.7 -21.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.714 ' HG ' ' H ' ' A' ' 61' ' ' ALA . 2.7 tt -55.06 -44.84 75.15 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.075 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.596 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 81.8 p -65.4 -29.57 70.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -74.19 -14.04 60.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.039 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 52.9 t -88.25 -55.88 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.186 0.517 . . . . 0.0 110.615 171.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.4 p -58.25 -42.51 86.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.579 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.596 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.1 mpt_? -59.14 -55.1 49.81 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.504 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 50.4 Cg_endo -72.18 -14.41 28.68 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.52 1.48 . . . . 0.0 113.17 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -14.09 59.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.806 0.336 . . . . 0.0 110.51 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.432 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 43.6 t -80.9 -13.67 58.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.774 -177.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.718 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.2 p -146.36 149.53 15.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -175.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.709 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 5.7 t60 -60.38 107.78 0.71 Allowed 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.718 ' HG3' HG13 ' A' ' 79' ' ' VAL . 34.6 mtp -140.68 170.36 9.7 Favored Pre-proline 0 CA--C 1.533 0.317 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -167.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.521 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 23.8 Cg_exo -41.25 2.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.865 1 C-N-CA 128.149 5.899 . . . . 0.0 119.125 174.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.617 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -38.5 -24.37 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 -166.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.884 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -65.2 -57.44 8.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.819 0.819 . . . . 0.0 109.477 170.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.7 ttpt -70.27 -14.45 62.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.732 179.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.617 HD11 ' HA ' ' A' ' 83' ' ' ALA . 38.2 mt -66.12 -27.09 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 122.06 -0.4 . . . . 0.0 110.539 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.603 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 50.8 t -75.61 -22.87 56.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.611 0.72 . . . . 0.0 109.65 175.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.8 mt-10 -75.64 -38.41 58.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.168 173.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -62.65 -35.99 81.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.647 171.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.529 HD22 HD13 ' A' ' 93' ' ' LEU . 21.4 mt -61.81 -28.68 69.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.313 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.558 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.7 mmmm -65.85 -24.06 66.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.602 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -81.69 -14.63 56.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.924 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.529 HD13 HD22 ' A' ' 90' ' ' LEU . 96.3 mt -94.37 -39.83 10.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.163 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -162.38 137.47 7.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.974 175.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 41.7 t -85.07 -21.92 29.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.163 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -68.59 -19.71 64.47 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.829 0.347 . . . . 0.0 110.844 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.446 HG12 ' HB3' ' A' ' 58' ' ' TYR . 51.7 mt -61.0 -30.17 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.305 0.574 . . . . 0.0 110.283 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.558 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 44.3 t -85.96 79.72 9.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.167 176.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.514 ' HB3' ' H ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER 179.37 -139.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.896 174.015 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.548 ' O ' HG23 ' A' ' 13' ' ' VAL . 6.7 mp 63.63 21.98 12.95 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.739 0.649 . . . . 0.0 111.131 177.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.422 ' HG2' ' OE1' ' A' ' 99' ' ' GLU . 33.4 mmtp -46.15 134.53 8.39 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 123.729 0.643 . . . . 0.0 112.078 -170.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.573 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.0 m-85 . . . . . 0 C--N 1.327 -0.403 0 O-C-N 123.388 0.43 . . . . 0.0 110.934 -174.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo . . . . . 0 N--CA 1.45 -1.053 0 CA-C-O 120.654 0.189 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.633 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -85.78 -37.46 9.41 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.818 -1.182 . . . . 0.0 112.271 -177.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 15' ' ' LYS . . . 175.33 -109.54 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.19 0.596 . . . . 0.0 109.879 -174.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -149.85 -35.22 0.17 Allowed 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 172.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.505 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 91.8 m -67.67 101.98 1.12 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.982 0.42 . . . . 0.0 109.943 173.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.67 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 39.3 tt0 -46.3 -59.9 2.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.645 -1.161 . . . . 0.0 113.895 -165.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.949 HG11 HD23 ' A' ' 55' ' ' LEU . 23.1 t -64.11 -47.97 87.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.356 0.598 . . . . 0.0 110.839 -176.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.779 ' HB2' HG23 ' A' ' 97' ' ' ILE . 5.1 t -59.22 -47.07 86.69 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.649 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 10.3 ptmm? -64.81 -38.29 90.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.308 -176.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 15.8 mm-40 -65.02 -42.9 93.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.605 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -62.61 -51.41 67.41 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.624 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 58.2 mt -62.39 -54.81 34.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.738 -176.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.633 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 28.5 t-20 -58.18 -45.61 87.22 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.271 0.357 . . . . 0.0 111.843 -174.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.445 HH22 ' HG2' ' A' ' 52' ' ' GLU . 87.0 mtm180 -64.11 -50.18 69.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.838 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -55.64 -47.65 76.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.328 1.061 . . . . 0.0 110.185 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.726 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 3.2 t80 -56.89 -52.14 66.32 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.807 -1.997 . . . . 0.0 112.412 -171.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.406 ' HE2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -83.46 -23.83 32.06 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.966 -177.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.638 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 42.6 m -57.02 -44.14 82.56 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.645 176.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.666 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 4.2 mp -63.91 -28.23 69.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.534 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 50.4 mm -71.63 -46.51 62.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 176.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.17 -46.9 81.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.859 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 1.056 ' HG3' HG23 ' A' ' 30' ' ' VAL . 20.5 ptp180 -85.31 -13.76 48.64 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.93 49.95 5.41 Favored Glycine 0 C--O 1.228 -0.239 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.439 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 1.056 HG23 ' HG3' ' A' ' 28' ' ' ARG . 59.0 t -118.71 3.46 7.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.688 1.232 . . . . 0.0 110.338 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.442 HD21 ' HA ' ' A' ' 31' ' ' ASN . 1.0 OUTLIER -96.92 174.49 6.76 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.303 -170.508 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 68.38 9.51 7.3 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.875 0.734 . . . . 0.0 112.018 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.471 ' O ' HG13 ' A' ' 37' ' ' ILE . 41.6 m -136.99 110.15 7.78 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.47 -35.14 75.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.313 -172.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.2 -36.24 74.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.375 0.607 . . . . 0.0 110.361 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.929 HG22 HG11 ' A' ' 30' ' ' VAL . 19.1 m -74.16 -39.87 62.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.494 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.487 HG21 HG22 ' A' ' 74' ' ' THR . 78.7 mt -61.37 -34.36 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.36 173.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.91 -50.33 69.15 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.909 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.407 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 25.1 mmmt -62.28 -42.15 99.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.708 -176.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' HG3' HG13 ' A' ' 30' ' ' VAL . 26.9 mm-40 -80.68 -16.78 53.09 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.503 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.591 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.3 tp -68.87 -41.23 78.67 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 172.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.558 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 1.7 mp -66.42 -41.44 88.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.46 173.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.401 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 32.2 t -64.03 -56.1 17.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.596 ' HA ' ' HB3' ' A' ' 47' ' ' ASP . 22.2 t80 -62.73 -28.78 70.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.223 0.535 . . . . 0.0 109.982 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.558 ' HB3' ' O ' ' A' ' 42' ' ' ILE . 53.8 t -49.2 -52.28 27.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.628 174.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.6 mt -89.55 -18.37 26.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.776 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.596 ' HB3' ' HA ' ' A' ' 44' ' ' PHE . 27.6 t70 -63.83 -29.16 70.38 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 111.173 -177.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.669 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -73.5 -169.63 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.945 177.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -100.37 173.44 6.59 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.365 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -45.56 -41.63 9.51 Favored Glycine 0 C--N 1.332 0.359 0 O-C-N 123.961 0.788 . . . . 0.0 114.453 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -59.45 -53.63 55.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.889 0.345 . . . . 0.0 111.177 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.669 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 2.1 mp0 -75.72 -27.66 58.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.467 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -61.42 -40.46 94.49 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -69.93 -43.42 71.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.197 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.949 HD23 HG11 ' A' ' 13' ' ' VAL . 23.9 tp -55.77 -35.81 66.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.941 178.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.97 -28.14 69.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.084 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -63.88 -31.94 73.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.153 0.501 . . . . 0.0 109.945 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -83.55 -23.21 32.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.357 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.95 -7.69 56.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.987 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.443 ' HA3' ' CG2' ' A' ' 69' ' ' ILE . . . 72.53 43.69 43.61 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.239 -0.891 . . . . 0.0 113.735 171.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.591 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -127.98 23.07 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.02 -117.76 0.31 Allowed 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.092 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -129.05 142.73 50.81 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 60.88 31.42 20.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.723 0.773 . . . . 0.0 109.842 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.439 ' HB1' ' HA2' ' A' ' 60' ' ' GLY . . . -104.23 -178.54 3.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.621 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.446 ' HB3' HG21 ' A' ' 69' ' ' ILE . . . -69.39 119.85 14.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.4 p -70.32 -28.02 64.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -72.0 -45.73 59.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.125 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.757 HD13 HD12 ' A' ' 90' ' ' LEU . 14.6 tt -66.03 -28.76 44.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.443 -175.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.448 HD12 HD21 ' A' ' 41' ' ' LEU . 46.5 tp -57.13 -45.53 83.44 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.373 0.606 . . . . 0.0 110.419 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.666 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 17.0 m -71.87 -37.48 70.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.246 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -64.33 -22.9 67.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.967 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 69' ' ' ILE . 94.3 t -86.19 -47.74 16.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.864 174.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.487 HG22 HG21 ' A' ' 37' ' ' ILE . 11.6 p -58.27 -33.64 69.62 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.666 ' HD2' ' O ' ' A' ' 71' ' ' SER . 5.5 mtt180 -67.29 -55.39 15.55 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.616 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 29.2 Cg_endo -67.34 -16.79 48.86 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.261 1.308 . . . . 0.0 113.01 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.6 mmt -78.2 -14.41 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.641 0.257 . . . . 0.0 111.002 175.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -79.89 -14.73 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.658 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.7 p -150.06 150.09 13.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -176.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.726 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 7.5 t60 -60.9 110.72 1.41 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.182 0.515 . . . . 0.0 110.122 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.658 ' HG3' HG13 ' A' ' 79' ' ' VAL . 48.2 mtp -137.6 173.73 5.11 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.345 -167.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.546 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 2.6 Cg_endo -40.64 0.9 0.0 OUTLIER 'Trans proline' 0 C--O 1.206 -1.081 1 C-N-CA 127.853 5.702 . . . . 0.0 118.863 175.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.528 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.41 -32.31 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.809 1.781 . . . . 0.0 115.809 -161.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.564 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 1.5 mtm -54.24 -48.05 71.54 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.965 0.888 . . . . 0.0 109.971 171.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 82' ' ' PRO . 3.1 mptp? -70.34 -29.95 66.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.677 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.528 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 50.2 mt -64.71 -29.73 48.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.052 0.453 . . . . 0.0 110.184 -174.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 52.6 t -61.28 -39.75 91.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.307 0.575 . . . . 0.0 109.993 172.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.488 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 15.8 mm-40 -72.05 -22.28 61.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.742 176.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -72.18 -38.87 69.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.757 HD12 HD13 ' A' ' 69' ' ' ILE . 2.8 mm? -66.76 -27.24 67.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.629 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.569 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.0 mmmm -63.51 -23.26 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.866 176.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -77.5 -17.45 57.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.778 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 mp -95.31 -40.87 9.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.608 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -164.32 135.31 4.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.796 0.332 . . . . 0.0 110.695 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.7 m -86.26 -15.48 40.61 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -67.63 -21.67 65.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.246 0.546 . . . . 0.0 110.341 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.779 HG23 ' HB2' ' A' ' 14' ' ' CYS . 57.3 mt -61.87 -23.58 31.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.33 176.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.569 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 24.2 t -89.43 -48.29 7.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.991 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -102.95 21.81 15.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.913 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.95 -42.91 99.65 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 101' ' ' LYS . 60.7 mmtt 63.79 163.3 0.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.55 -1.205 . . . . 0.0 113.883 174.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.789 179.459 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.448 -1.153 0 CA-C-O 121.117 0.382 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.915 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -84.39 -26.18 40.61 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.808 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.628 ' HB3' ' HB3' ' A' ' 87' ' ' CYS . . . -172.31 -83.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.119 0.485 . . . . 0.0 111.039 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t70 176.02 -27.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.594 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 5.4 m -73.09 -147.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.095 169.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.449 ' HA ' ' HE2' ' A' ' 15' ' ' LYS . 35.5 tt0 -130.34 -73.84 0.55 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.117 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.915 HG13 HD21 ' A' ' 55' ' ' LEU . 93.8 t -60.48 -47.92 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.498 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.664 ' HA ' HD22 ' A' ' 55' ' ' LEU . 41.9 t -58.56 -37.69 76.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.185 0.517 . . . . 0.0 110.154 174.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.705 ' HG3' ' CA ' ' A' ' 8' ' ' GLY . 27.7 ttpt -64.65 -55.55 19.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.847 -179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.473 ' HB2' ' HH ' ' A' ' 102' ' ' TYR . 61.9 mm-40 -58.94 -44.89 91.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.898 -177.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -58.02 -56.66 19.18 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.237 0.335 . . . . 0.0 111.717 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' ' 87' ' ' CYS . 97.9 mt -60.1 -48.32 82.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.722 0.296 . . . . 0.0 111.022 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.915 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.0 t-20 -67.06 -41.72 85.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.355 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -78.05 -34.26 50.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.925 -175.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.46 -47.04 87.52 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.825 0.821 . . . . 0.0 109.246 172.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.72 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.6 t80 -56.59 -49.88 73.6 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 113.604 -1.635 . . . . 0.0 111.22 -177.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -71.57 -31.7 67.26 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.319 -179.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.503 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 73.1 m -60.16 -38.33 82.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.383 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.65 ' HG ' ' CG2' ' A' ' 30' ' ' VAL . 4.3 mp -73.73 -22.46 59.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.011 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 46.9 mm -80.35 -43.81 21.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.03 -55.18 35.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.806 174.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.406 ' HB2' HG11 ' A' ' 30' ' ' VAL . 53.9 mtm-85 -78.93 -14.72 59.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.892 -175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.24 31.66 74.91 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.765 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.65 ' CG2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 m -99.01 3.38 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 122.044 0.926 . . . . 0.0 110.47 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.609 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.6 t-20 -83.62 174.15 10.78 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.093 -169.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.2 t80 75.39 -11.03 1.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.006 0.923 . . . . 0.0 110.795 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 37' ' ' ILE . 24.2 m -100.47 105.41 16.86 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.615 HD21 ' HE ' ' A' ' 75' ' ' ARG . 12.3 tp -62.78 -38.04 89.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.812 -171.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -63.0 -42.04 99.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.401 0.619 . . . . 0.0 110.215 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.7 m -67.27 -38.86 85.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.275 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 33' ' ' SER . 73.9 mt -58.18 -34.17 48.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.724 0.297 . . . . 0.0 110.284 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -69.1 -45.26 70.67 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.463 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -62.94 -40.0 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.195 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.5 ' HG3' HG21 ' A' ' 30' ' ' VAL . 10.0 mm-40 -68.65 -39.39 80.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.309 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.596 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 17.9 mt -55.62 -55.64 29.66 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 120.767 0.318 . . . . 0.0 110.144 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.566 HD11 HD11 ' A' ' 70' ' ' LEU . 1.7 mp -57.47 -46.13 85.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.997 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -61.34 -51.09 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.491 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -61.88 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.068 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.8 m -65.4 -28.59 69.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.521 -178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -86.62 -49.26 7.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -82.32 63.8 6.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.424 0.631 . . . . 0.0 111.067 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -150.92 -161.45 1.34 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.693 178.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 pttm -103.18 166.86 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 121.081 -0.248 . . . . 0.0 111.241 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.36 -43.48 26.96 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 124.068 0.855 . . . . 0.0 114.398 -170.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.808 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.0 mptt -58.37 -47.69 83.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.234 0.517 . . . . 0.0 111.249 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.82 -41.08 68.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.507 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -58.09 -44.18 87.49 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -70.01 -41.86 73.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.871 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.915 HD21 HG13 ' A' ' 13' ' ' VAL . 23.5 tp -53.62 -42.78 68.09 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.691 -177.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.402 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 86.2 m -67.34 -14.13 62.64 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -72.31 -25.73 61.68 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.492 ' HB3' HG12 ' A' ' 97' ' ' ILE . 77.0 m-85 -84.99 -40.25 17.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.75 175.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.417 HD22 HD11 ' A' ' 97' ' ' ILE . 82.5 mt -74.08 -18.8 60.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.39 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.05 -13.5 63.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.293 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.596 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -85.59 75.44 10.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.21 0.529 . . . . 0.0 111.582 -176.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 63' ' ' LYS . 5.8 m -152.78 176.77 11.43 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.595 ' H ' HG22 ' A' ' 62' ' ' THR . 29.4 mtpp -63.17 -37.69 88.21 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.63 -152.69 0.32 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.201 -0.908 . . . . 0.0 109.21 174.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.52 -164.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 112.201 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.75 126.8 34.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.567 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.4 p -86.18 -21.16 27.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.993 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -81.28 -44.92 17.01 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.361 -175.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.479 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 13.9 tt -63.33 -24.61 36.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.428 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.566 HD11 HD11 ' A' ' 42' ' ' ILE . 3.3 tt -60.14 -44.25 95.09 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 174.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.634 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 19.0 m -66.51 -18.87 65.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.01 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.551 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 27.8 mm-40 -71.62 -56.08 6.53 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.28 -45.25 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.41 0.444 . . . . 0.0 111.921 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.4 p -55.24 -34.28 63.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.634 ' HD3' ' O ' ' A' ' 71' ' ' SER . 3.1 mpt_? -66.5 -56.45 15.32 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.86 -173.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.718 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 25.8 Cg_endo -65.61 -30.13 51.58 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.624 1.549 . . . . 0.0 112.977 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.2 mmt -67.79 -14.13 62.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.16 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -78.35 -15.27 58.88 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.451 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.552 HG22 ' HG3' ' A' ' 81' ' ' MET . 4.0 m -144.23 -169.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.933 0.397 . . . . 0.0 111.386 -174.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.72 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 58.1 t60 -89.57 99.44 12.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.718 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 38.9 mtp -136.34 169.67 12.89 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -170.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.564 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.1 Cg_endo -42.44 -0.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.935 1 C-N-CA 127.809 5.672 . . . . 0.0 118.128 177.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.647 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -36.82 -35.07 0.08 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -159.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.63 ' HG2' ' H ' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.72 -51.65 57.58 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 118.664 0.665 . . . . 0.0 110.513 177.014 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.63 ' H ' ' HG2' ' A' ' 84' ' ' MET . 42.7 mtmt -67.21 -19.49 65.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.711 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.647 HD11 ' HA ' ' A' ' 83' ' ' ALA . 27.9 mt -63.86 -28.97 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.912 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.628 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 49.3 t -68.84 -35.07 76.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.717 176.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.839 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 67.7 mm-40 -68.21 -28.54 67.34 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.792 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.486 ' CD ' ' HA ' ' A' ' 86' ' ' ILE . 31.7 mttm -74.72 -40.14 61.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.24 177.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 92.3 mt -68.35 -25.21 64.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.183 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.839 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 58.2 mtpt -61.24 -21.24 63.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.526 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -76.18 -22.16 55.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.099 0.476 . . . . 0.0 110.386 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.2 -53.23 4.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 96' ' ' GLN . 10.8 t70 -138.18 115.01 10.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.423 177.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.1 m -82.62 -15.01 53.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.792 0.33 . . . . 0.0 111.336 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.425 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 2.1 mp0 -65.74 -34.86 79.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.919 -177.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.492 HG12 ' HB3' ' A' ' 58' ' ' TYR . 78.3 mt -48.04 -42.0 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.47 176.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.596 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 35.9 t -72.68 -42.27 64.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.885 -173.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -81.31 14.5 2.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.67 116.03 21.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 170.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.435 ' HD3' ' HB3' ' A' ' 12' ' ' GLU . 32.4 mmtp -116.58 149.65 39.31 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.808 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 98.9 m-85 . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 177.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo . . . . . 0 N--CA 1.446 -1.293 0 CA-C-O 121.027 0.345 . . . . 0.0 111.605 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.654 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -96.71 -19.73 26.3 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.439 -176.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.773 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . 173.21 -153.08 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.208 0.603 . . . . 0.0 109.725 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -121.39 -36.67 3.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.641 0.258 . . . . 0.0 110.354 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 42.3 m -56.36 -81.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.869 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.822 ' HA ' ' HE3' ' A' ' 15' ' ' LYS . 7.3 tp10 170.41 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.727 0.299 . . . . 0.0 111.627 172.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.655 HG13 HD22 ' A' ' 55' ' ' LEU . 53.5 t -64.59 -38.16 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.477 -172.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.512 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 21.7 p -60.24 -30.71 69.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 174.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.822 ' HE3' ' HA ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -72.18 -41.65 66.75 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.219 -175.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.453 ' HB3' HH11 ' A' ' 20' ' ' ARG . 43.6 mm-40 -56.23 -48.47 76.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.667 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -61.55 -54.98 35.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.144 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 96.0 mt -59.57 -48.16 82.76 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.488 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.7 t-20 -68.5 -44.75 74.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.453 HH11 ' HB3' ' A' ' 16' ' ' GLU . 30.7 mtp180 -64.63 -39.19 93.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.687 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.533 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 76.2 t80 -62.69 -50.24 71.92 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.954 0.883 . . . . 0.0 109.684 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.518 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 29.9 t80 -47.37 -55.06 9.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.84 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.62 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -68.74 -37.74 79.64 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.204 -179.303 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.62 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 27.2 t -59.23 -33.18 70.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.388 0.613 . . . . 0.0 110.758 -175.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.571 ' HA ' HG11 ' A' ' 30' ' ' VAL . 2.9 mp -83.04 -46.69 12.54 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.573 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 22' ' ' TYR . 28.8 mm -67.34 -37.78 79.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.176 0.513 . . . . 0.0 110.225 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -72.28 -46.07 57.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.407 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.946 ' HG2' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -82.08 -14.15 56.24 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.031 0.443 . . . . 0.0 110.75 -177.028 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.58 1.78 60.28 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.061 172.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.946 HG12 ' HG2' ' A' ' 28' ' ' ARG . 1.9 p -87.94 99.02 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.546 ' OD1' ' HA ' ' A' ' 78' ' ' SER . 7.5 t-20 -165.73 -176.96 4.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.969 -0.457 . . . . 0.0 111.253 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 62.5 38.57 12.51 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.35 0.66 . . . . 0.0 111.54 -177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.589 ' O ' HG12 ' A' ' 37' ' ' ILE . 55.5 m -157.8 104.94 1.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.913 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.95 -43.68 91.29 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -172.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.46 -38.25 83.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.25 0.548 . . . . 0.0 110.715 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.1 m -73.6 -40.82 63.55 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.333 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 33' ' ' SER . 35.9 mm -58.58 -37.61 65.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -69.46 -44.26 71.58 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 32.3 mmtm -77.0 -18.8 57.96 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.925 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.484 ' HG3' HG21 ' A' ' 30' ' ' VAL . 62.1 mm-40 -85.35 -28.02 25.48 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.933 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.609 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 13.2 mt -59.71 -55.46 34.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 168.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.415 HD11 ' HD3' ' A' ' 39' ' ' LYS . 60.4 mt -53.63 -43.85 55.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.069 176.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -63.85 -48.1 78.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.905 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -68.55 -32.92 73.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.854 0.359 . . . . 0.0 110.595 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 91.3 m -66.07 -22.62 66.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.946 0.403 . . . . 0.0 110.872 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.8 tp -87.64 -41.57 13.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.104 172.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -79.17 48.35 0.86 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.712 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -142.05 -172.65 3.62 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.521 177.773 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -97.56 173.46 7.14 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.58 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.51 -43.25 58.59 Favored Glycine 0 C--N 1.33 0.224 0 O-C-N 123.548 0.53 . . . . 0.0 114.022 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.443 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.7 tppt? -61.14 -42.25 98.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.135 0.493 . . . . 0.0 110.153 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.712 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 20.6 mt-10 -78.27 -37.56 44.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.766 -176.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -57.54 -40.57 79.12 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -78.96 -36.38 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.633 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.655 HD22 HG13 ' A' ' 13' ' ' VAL . 38.3 tp -53.63 -34.62 59.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.569 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.615 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 9.2 t -68.12 -15.35 63.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.403 ' CZ ' HG22 ' A' ' 62' ' ' THR . 77.4 m-85 -74.56 -21.09 59.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.292 0.568 . . . . 0.0 109.964 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.488 ' HB3' HG12 ' A' ' 97' ' ' ILE . 98.7 m-85 -86.12 -34.56 20.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.008 174.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.78 -36.11 67.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.503 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.56 -3.76 34.6 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 121.057 -0.592 . . . . 0.0 113.862 172.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.615 ' HB1' ' SG ' ' A' ' 56' ' ' CYS . . . -92.44 53.22 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -173.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.427 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -126.07 -84.94 0.62 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.058 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.427 ' H ' ' HB ' ' A' ' 62' ' ' THR . 27.5 mtpp -146.09 -70.21 0.26 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.138 0.494 . . . . 0.0 110.067 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -126.59 101.62 6.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.958 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -161.18 -79.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.753 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -148.41 60.99 1.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.308 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -68.65 -19.22 64.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.536 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -81.51 -27.28 34.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.026 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.511 ' HB ' HD23 ' A' ' 93' ' ' LEU . 6.7 pt -86.11 -18.93 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-O 121.368 0.604 . . . . 0.0 109.547 175.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.596 HD23 ' HB2' ' A' ' 61' ' ' ALA . 2.7 tm? -65.72 -26.85 67.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.712 -173.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.663 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 2.6 m -60.32 -27.85 67.67 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.322 0.582 . . . . 0.0 110.698 178.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.646 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 8.8 tp10 -72.2 -14.69 61.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.406 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.58 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 58.1 t -87.91 -53.22 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.008 0.432 . . . . 0.0 110.484 172.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -55.48 -53.08 60.78 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -172.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' A' ' 71' ' ' SER . 1.5 mtp-105 -58.48 -51.73 79.72 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.686 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.724 ' HB3' ' SD ' ' A' ' 81' ' ' MET . 47.9 Cg_exo -61.52 -39.43 55.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.565 1.51 . . . . 0.0 113.361 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.5 ' HG3' ' HE2' ' A' ' 21' ' ' PHE . 23.8 mmt -61.81 -16.68 51.91 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.882 0.372 . . . . 0.0 111.281 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.546 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 40.6 t -75.31 -11.76 60.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.572 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 80' ' ' HIS . 9.9 p -136.95 168.67 21.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.409 ' H ' HG22 ' A' ' 79' ' ' VAL . 51.2 t60 -71.02 96.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.827 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -118.12 158.78 45.41 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.854 -163.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.827 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 25.0 Cg_exo -40.55 3.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.745 1 C-N-CA 127.831 5.687 . . . . 0.0 118.034 167.618 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.631 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -38.91 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -163.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.654 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -64.51 -48.56 74.7 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.955 1.252 . . . . 0.0 109.583 173.116 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.583 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 34.8 ttmt -66.29 -20.7 66.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.198 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.631 HD13 ' HA ' ' A' ' 83' ' ' ALA . 44.8 mt -66.22 -30.85 51.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.059 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 90' ' ' LEU . 50.0 t -78.46 -20.34 51.15 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.887 176.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.583 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 4.8 tp10 -64.34 -50.75 66.55 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 46.8 mtmt -63.17 -33.25 75.06 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.515 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 13.3 mt -61.87 -21.86 65.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.677 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.637 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 26.7 mtmm -64.61 -24.03 67.46 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.964 -176.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 92' ' ' LYS . 24.6 tptp -79.78 -19.09 49.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.205 0.526 . . . . 0.0 110.254 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.511 HD23 ' HB ' ' A' ' 69' ' ' ILE . 6.8 mp -85.87 -48.16 9.0 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -160.44 122.61 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.992 174.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -84.37 -14.01 50.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.007 0.432 . . . . 0.0 110.959 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -75.28 -14.29 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.488 HG12 ' HB3' ' A' ' 58' ' ' TYR . 83.3 mt -60.61 -33.05 53.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 122.001 0.905 . . . . 0.0 109.181 170.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.637 ' SG ' ' HG2' ' A' ' 91' ' ' LYS . 90.9 m -87.67 -51.4 5.9 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.597 -177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.09 43.94 1.04 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.195 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.551 ' O ' HG22 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -111.53 48.76 0.93 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -62.01 158.04 17.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.395 -172.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.443 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 71.2 m-85 . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.952 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 N--CA 1.46 -0.49 0 N-CA-C 111.01 -0.419 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.927 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -66.77 -41.2 93.79 Favored Glycine 0 N--CA 1.439 -1.132 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.525 -169.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.599 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -179.51 -82.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.545 0.688 . . . . 0.0 110.953 -173.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -165.21 -70.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.635 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 p -68.33 128.92 38.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.429 175.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.675 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 34.2 mp0 -48.26 -76.92 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.829 HG12 HD23 ' A' ' 55' ' ' LEU . 59.3 t -51.73 -42.47 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.3 t -63.87 -46.23 85.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.073 0.463 . . . . 0.0 110.27 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.1 ptmt -68.96 -36.52 78.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.435 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.1 mm-40 -61.84 -51.38 68.47 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.096 -178.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -65.01 -54.51 29.29 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.334 -176.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.548 HD13 ' SG ' ' A' ' 87' ' ' CYS . 71.3 mt -58.08 -52.95 63.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -174.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.927 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -68.54 -36.2 78.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.937 0.399 . . . . 0.0 111.309 -175.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -73.68 -39.12 64.63 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.33 -178.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.529 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 87.3 t80 -61.84 -49.37 76.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.589 0.709 . . . . 0.0 109.241 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.438 ' O ' HG12 ' A' ' 26' ' ' ILE . 40.8 t80 -48.86 -47.89 42.41 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.05 178.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -77.57 -46.93 20.75 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.6 t -57.7 -29.03 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.092 0.473 . . . . 0.0 110.683 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 3.9 tp -72.03 -41.61 67.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.446 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 22' ' ' TYR . 40.7 mm -68.66 -36.67 75.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.488 0.661 . . . . 0.0 109.637 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.39 -45.67 86.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.387 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 28' ' ' ARG . 18.1 mtp180 -70.19 -26.1 63.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.404 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.95 12.44 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.564 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.658 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.41 126.7 71.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 114.749 -0.725 . . . . 0.0 109.339 -178.464 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.535 ' O ' HD13 ' A' ' 37' ' ' ILE . 2.0 t-20 -173.91 -45.18 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 175.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -79.54 47.36 0.82 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.335 0.588 . . . . 0.0 111.784 -173.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 37' ' ' ILE . 20.4 m -157.88 109.56 2.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.825 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.551 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.9 mm? -57.88 -41.64 82.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.977 -176.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -59.09 -41.95 89.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.232 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -70.72 -42.65 70.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.514 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 31' ' ' ASN . 67.3 mt -57.69 -37.39 59.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -71.16 -47.24 58.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.086 -178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.654 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -60.97 -43.38 98.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.449 ' HG3' HG23 ' A' ' 30' ' ' VAL . 4.8 mm-40 -78.55 -27.04 45.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -176.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.529 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 6.2 mt -59.28 -48.83 80.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.51 -47.27 85.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.67 175.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.5 m -60.05 -47.28 86.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.299 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -71.09 -38.51 72.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.48 -175.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 54.5 m -66.62 -28.65 68.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -86.02 -20.14 29.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.093 0.473 . . . . 0.0 110.641 176.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -87.47 -24.64 24.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.314 -175.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.747 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -70.13 -173.76 0.72 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.846 -179.445 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -96.34 174.36 6.91 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.284 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.01 -47.86 39.68 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 114.758 0.663 . . . . 0.0 114.758 -169.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -61.2 -36.35 79.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.258 0.529 . . . . 0.0 111.371 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.747 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.0 mt-10 -80.67 -38.75 28.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.094 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.1 -47.32 83.61 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -64.35 -38.5 91.25 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.735 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.829 HD23 HG12 ' A' ' 13' ' ' VAL . 34.1 tp -57.88 -36.87 72.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.5 m -70.92 -17.39 62.69 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.72 -29.7 67.16 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -86.17 -38.61 17.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.36 177.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.1 mt -73.22 -25.88 60.91 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.571 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.603 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 106.12 -9.52 42.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.487 174.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.479 ' HA ' HD12 ' A' ' 70' ' ' LEU . . . -81.78 55.85 2.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.724 0.773 . . . . 0.0 111.118 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 64' ' ' ASP . 24.8 m -156.82 140.71 16.19 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -75.68 19.72 0.19 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.039 0.447 . . . . 0.0 112.023 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.441 ' H ' ' C ' ' A' ' 62' ' ' THR . 1.2 m-20 -127.16 1.93 6.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.886 176.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.92 -174.16 2.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.775 -172.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.435 ' HB2' HG23 ' A' ' 69' ' ' ILE . . . -67.66 136.51 54.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.961 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 p -84.41 -35.52 23.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.854 -175.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -72.88 -22.49 60.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.07 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.603 HG22 ' HA3' ' A' ' 60' ' ' GLY . 18.1 tt -85.67 -24.92 6.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.256 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 61' ' ' ALA . 21.2 tp -61.5 -43.55 98.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.439 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.587 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 16.0 p -68.57 -23.01 64.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -75.89 -19.94 58.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.652 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.428 ' O ' ' HG2' ' A' ' 77' ' ' MET . 48.3 t -88.73 -52.09 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.282 172.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.497 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 18.4 p -55.27 -49.45 72.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.587 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.0 mpt_? -55.46 -54.59 49.41 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -176.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.52 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 27.7 Cg_endo -66.49 -13.27 39.22 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.898 1.732 . . . . 0.0 114.41 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 24.4 mmt -77.25 -25.38 51.47 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.087 176.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 t -73.63 -13.97 61.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.202 -175.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.37 163.53 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.402 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 75.2 t60 -70.14 89.28 0.63 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.36 0.527 . . . . 0.0 110.201 178.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.52 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 5.3 mtp -110.29 176.86 1.37 Allowed Pre-proline 0 C--N 1.318 -0.767 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.337 -176.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.541 ' C ' HG13 ' A' ' 86' ' ' ILE . 33.1 Cg_exo -42.69 -0.17 0.01 OUTLIER 'Trans proline' 0 C--O 1.212 -0.801 1 C-N-CA 126.113 4.542 . . . . 0.0 116.904 171.162 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.652 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -38.55 -41.07 0.64 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.133 1.333 . . . . 0.0 114.052 -169.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.68 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -61.98 -56.87 14.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.043 0.925 . . . . 0.0 109.543 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 39.3 ttmt -62.07 -14.53 37.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.232 178.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.652 HD11 ' HA ' ' A' ' 83' ' ' ALA . 42.0 mt -70.51 -26.01 27.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 O-C-N 122.037 -0.414 . . . . 0.0 111.3 -177.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.548 ' SG ' HD13 ' A' ' 18' ' ' LEU . 84.8 m -73.05 -17.48 61.42 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.816 0.817 . . . . 0.0 110.213 173.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.509 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.9 mt-10 -85.94 -45.34 11.59 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.187 171.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 86' ' ' ILE . 26.4 ttpp -64.06 -38.18 90.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.384 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.19 -14.48 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -66.82 -14.92 63.21 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.953 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -67.36 -29.13 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.463 0.649 . . . . 0.0 109.56 173.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.407 HD12 ' N ' ' A' ' 93' ' ' LEU . 6.6 mp -94.23 -47.41 6.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.109 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -161.27 124.15 3.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.022 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.4 p -86.82 -16.16 37.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.739 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.649 ' HA ' ' HG2' ' A' ' 99' ' ' GLU . 1.9 mp0 -72.15 -19.67 61.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.717 0.294 . . . . 0.0 111.346 -175.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.66 -30.8 22.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.332 0.587 . . . . 0.0 110.585 174.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 13.3 m -82.45 -24.76 34.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.592 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.649 ' HG2' ' HA ' ' A' ' 96' ' ' GLN . 11.8 pt-20 -100.6 20.65 14.69 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.45 -63.6 1.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt 66.19 131.7 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.748 177.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.278 179.689 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo . . . . . 0 N--CA 1.444 -1.389 0 CA-C-O 120.793 0.247 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.759 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -88.09 -23.17 38.89 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.883 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.531 ' N ' ' HG2' ' A' ' 15' ' ' LYS . . . 172.92 -129.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.33 -0.935 . . . . 0.0 108.487 -175.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -139.3 -33.38 0.62 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 169.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.607 ' HB3' ' O ' ' A' ' 98' ' ' CYS . 26.5 m -60.38 106.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.976 167.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -48.88 -69.52 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -165.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.508 HG13 ' HB2' ' A' ' 100' ' ' LEU . 14.3 p -59.46 -31.37 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.613 0.721 . . . . 0.0 110.52 -174.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 11' ' ' CYS . 51.2 t -69.88 -35.81 74.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.371 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.602 ' HG3' ' O ' ' A' ' 11' ' ' CYS . 55.9 mtpt -57.04 -53.79 54.05 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.266 0.555 . . . . 0.0 109.915 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' HH11 ' A' ' 20' ' ' ARG . 13.5 mm-40 -53.7 -51.78 62.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.318 -177.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.656 ' HE2' ' HA ' ' A' ' 45' ' ' CYS . 43.6 t80 -61.4 -55.44 31.38 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.86 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.95 -49.41 77.55 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -174.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.759 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 25.5 t-20 -68.56 -46.8 68.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.354 -174.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.516 HH11 ' HB3' ' A' ' 16' ' ' GLU . 46.2 mtp180 -63.18 -41.27 99.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.114 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.03 -48.67 80.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.622 0.725 . . . . 0.0 109.827 175.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.621 ' HE2' ' H ' ' A' ' 81' ' ' MET . 47.9 t80 -51.91 -55.85 17.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.201 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.601 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -73.51 -30.23 62.99 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.329 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.601 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 71.9 m -64.62 -45.85 85.13 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 121.205 -0.198 . . . . 0.0 110.47 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.2 mp -63.46 -41.41 98.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.588 0.233 . . . . 0.0 111.36 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 22' ' ' TYR . 39.7 mm -67.23 -40.03 84.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.057 0.456 . . . . 0.0 110.278 177.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.57 -44.94 73.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.148 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 28' ' ' ARG . 10.2 mtp180 -72.04 -15.26 62.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.1 39.43 27.39 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.508 HG21 ' HG3' ' A' ' 40' ' ' GLU . 0.7 OUTLIER -130.92 98.76 3.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.204 0.526 . . . . 0.0 110.123 -177.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.404 HD21 ' HA ' ' A' ' 31' ' ' ASN . 1.4 t-20 -168.49 -177.83 3.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.057 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 57.3 31.98 21.01 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.289 0.566 . . . . 0.0 111.515 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.585 ' O ' HG12 ' A' ' 37' ' ' ILE . 62.8 m -150.75 107.56 3.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 176.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.67 HD12 ' HE ' ' A' ' 75' ' ' ARG . 95.1 mt -60.09 -41.64 92.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.391 -170.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -67.59 -28.94 68.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.257 0.551 . . . . 0.0 109.874 -178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 m -78.14 -37.5 45.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.859 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 33' ' ' SER . 17.0 mm -64.6 -32.54 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.466 ' CG ' HG23 ' A' ' 74' ' ' THR . 41.1 mt-10 -66.01 -23.68 66.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.694 178.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -85.77 -52.48 5.74 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.147 0.498 . . . . 0.0 110.382 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.508 ' HG3' HG21 ' A' ' 30' ' ' VAL . 7.1 mm-40 -71.64 -25.9 62.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.46 -171.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.626 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 7.3 mt -58.45 -38.38 77.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 171.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.1 mt -74.71 -45.96 43.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.144 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 m -57.58 -45.21 85.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.177 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -78.3 -32.93 49.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.954 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.656 ' HA ' ' HE2' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -73.06 -19.41 61.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.342 0.591 . . . . 0.0 110.14 -179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.0 tp -86.35 -41.23 14.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.044 170.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.73 63.61 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.661 0.743 . . . . 0.0 110.492 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.728 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -158.71 -172.42 3.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.595 -179.146 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -98.71 171.49 8.07 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.061 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.69 -43.88 38.12 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 123.644 0.59 . . . . 0.0 114.573 -171.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 7.7 tptp -63.09 -35.36 80.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.312 0.577 . . . . 0.0 110.681 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.728 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 16.0 mt-10 -85.48 -36.43 20.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.242 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.562 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 14.1 m120 -61.39 -39.06 89.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.552 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.491 ' HA ' ' HD2' ' A' ' 54' ' ' ARG . 19.7 tpt180 -75.08 -35.72 61.79 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.1 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.564 HD13 HD12 ' A' ' 100' ' ' LEU . 49.6 tp -58.66 -25.18 62.51 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.333 0.587 . . . . 0.0 110.361 175.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.562 ' HB3' ' O ' ' A' ' 53' ' ' ASN . 13.2 t -62.29 -32.38 73.09 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.391 176.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -74.91 -17.92 60.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 0.0 109.807 177.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.66 ' HB3' HG12 ' A' ' 97' ' ' ILE . 84.8 m-85 -86.08 -55.13 4.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.904 176.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.8 -18.36 65.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.621 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 82.64 36.13 17.37 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.416 175.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.425 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . . . -93.63 16.87 12.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.215 0.531 . . . . 0.0 110.587 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.492 HG22 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -132.91 128.58 36.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.468 178.097 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HA ' HG23 ' A' ' 67' ' ' THR . 54.9 mtpt -76.91 -10.3 59.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.182 0.515 . . . . 0.0 110.262 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -74.86 -14.82 60.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.039 174.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.29 -139.65 0.32 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.872 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.63 102.04 0.06 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.158 0.504 . . . . 0.0 109.93 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.442 HG23 ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -86.39 -37.84 17.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.149 -169.298 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -72.28 -35.96 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.511 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.621 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.3 tt -64.12 -23.85 34.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.266 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.97 -49.95 70.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.442 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 8.0 m -66.48 -27.19 67.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.753 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -75.29 -21.51 58.44 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.064 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.545 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.0 t -87.21 -41.91 14.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.943 173.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.466 HG23 ' CG ' ' A' ' 38' ' ' GLU . 39.7 p -60.68 -42.03 96.3 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.67 ' HE ' HD12 ' A' ' 34' ' ' LEU . 4.3 mpt_? -55.69 -53.47 62.36 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.517 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.545 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 31.8 Cg_exo -62.52 -45.78 13.56 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.865 1.71 . . . . 0.0 112.828 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 14.3 mmt -62.78 -14.81 49.5 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.4 t -66.79 -14.45 62.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.423 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.02 162.26 34.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -61.63 107.1 0.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 175.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.85 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -119.68 153.42 54.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -163.166 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.85 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 24.9 Cg_exo -40.56 3.48 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.952 1 C-N-CA 127.923 5.749 . . . . 0.0 117.919 167.183 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.678 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.59 -31.7 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 115.618 1.71 . . . . 0.0 115.618 -164.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.482 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -50.93 -49.32 60.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.462 0.648 . . . . 0.0 110.257 173.158 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 18.0 ptpt -85.81 -15.16 42.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.474 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.792 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 15.2 mt -59.39 -42.67 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.538 ' HA ' HD11 ' A' ' 90' ' ' LEU . 19.4 t -67.32 -22.07 65.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.286 0.565 . . . . 0.0 111.102 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 15.5 tp10 -76.41 -44.16 37.25 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.792 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 10.1 mtmp? -61.11 -24.96 66.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.17 176.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.538 HD11 ' HA ' ' A' ' 87' ' ' CYS . 23.1 mt -66.75 -17.82 65.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.264 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -63.53 -20.62 65.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.782 0.325 . . . . 0.0 110.806 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -69.04 -29.51 67.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.181 0.515 . . . . 0.0 110.333 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.56 -59.49 2.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.321 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -151.33 134.2 15.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.345 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.9 m -85.24 -19.55 31.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.465 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -68.07 -30.87 70.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.894 0.378 . . . . 0.0 110.668 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.66 HG12 ' HB3' ' A' ' 58' ' ' TYR . 20.2 mt -56.55 -33.55 39.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.234 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.607 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 53.7 t -75.04 -35.98 61.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.748 -174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -85.99 -107.92 0.05 Allowed 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.298 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.564 HD12 HD13 ' A' ' 55' ' ' LEU . 73.7 mt 64.39 -69.45 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.888 0.475 . . . . 0.0 111.059 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 70.2 149.25 0.08 Allowed 'General case' 0 C--O 1.231 0.119 0 O-C-N 123.931 0.769 . . . . 0.0 110.836 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.357 174.125 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.444 -1.436 0 N-CA-C 111.226 -0.336 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.586 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -76.14 -29.94 57.91 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 119.065 -1.541 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.447 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.43 -94.08 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.481 -0.86 . . . . 0.0 109.201 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.425 ' HB3' ' CD ' ' A' ' 88' ' ' GLU . 19.3 t70 -164.25 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 170.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 92.5 m -59.8 166.72 2.47 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.402 166.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 40.2 tt0 -89.77 -77.73 0.38 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -167.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.83 HG11 HD21 ' A' ' 55' ' ' LEU . 59.6 t -55.04 -42.57 65.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.289 0.566 . . . . 0.0 111.322 -170.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.666 ' HA ' HD22 ' A' ' 55' ' ' LEU . 20.8 t -63.51 -36.0 82.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.73 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.525 ' HG3' ' N ' ' A' ' 16' ' ' GLU . 2.5 ptpp? -69.25 -35.61 76.29 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.68 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.525 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 61.7 mm-40 -56.88 -55.15 38.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.628 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -57.42 -55.04 39.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.821 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.562 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.0 mt -61.5 -38.84 88.78 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.048 -173.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -64.45 -55.36 21.39 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.17 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.57 -55.56 24.6 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.24 -50.71 61.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.529 0.68 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.563 ' O ' HG12 ' A' ' 26' ' ' ILE . 54.9 t80 -53.79 -55.27 27.95 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 113.998 -1.456 . . . . 0.0 111.257 -178.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.637 ' HB2' ' HZ2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.95 -34.02 59.84 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.527 -176.233 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 75.2 m -58.29 -46.26 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.664 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.594 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 2.4 mp -66.33 -44.91 81.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.072 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 22' ' ' TYR . 48.6 mm -59.88 -38.69 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.608 177.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -64.1 -39.38 93.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.864 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.493 ' HB3' HG21 ' A' ' 30' ' ' VAL . 32.6 mtm180 -83.23 -14.85 52.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.115 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.0 15.35 62.99 Favored Glycine 0 N--CA 1.453 -0.177 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.594 ' HB ' ' HG ' ' A' ' 25' ' ' LEU . 43.7 t -93.74 106.0 17.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 114.245 -0.978 . . . . 0.0 110.043 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.692 ' HA ' HD11 ' A' ' 37' ' ' ILE . 1.0 OUTLIER -164.43 -55.26 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 118.499 -1.28 . . . . 0.0 114.212 176.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.443 ' HA ' ' HG ' ' A' ' 78' ' ' SER . 19.4 t80 -78.74 59.04 2.43 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.637 0.732 . . . . 0.0 110.575 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.795 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 13.5 m -157.95 101.65 1.79 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.063 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.45 -46.74 76.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.807 -176.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.93 -30.68 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.279 0.561 . . . . 0.0 110.47 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.795 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 51.6 m -76.02 -46.33 29.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.498 -177.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.692 HD11 ' HA ' ' A' ' 31' ' ' ASN . 32.3 mm -58.52 -33.8 49.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -63.27 -50.71 69.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.884 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -65.21 -39.0 92.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.357 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.492 ' HG3' HG12 ' A' ' 30' ' ' VAL . 53.6 mm-40 -70.19 -40.64 74.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.299 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.563 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 16.8 mt -55.5 -55.54 30.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 59.2 mt -54.76 -47.43 74.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.429 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.4 m -63.93 -51.27 65.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.503 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -67.05 -35.37 79.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.052 0.453 . . . . 0.0 110.353 -176.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 61' ' ' ALA . 60.7 m -66.97 -33.63 75.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.243 -179.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 46' ' ' LEU . 4.1 mm? -87.63 -20.73 25.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.904 0.383 . . . . 0.0 111.419 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.68 -31.57 61.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.062 0.458 . . . . 0.0 111.262 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -69.66 -170.42 0.3 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.876 -178.255 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -95.82 171.18 8.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.113 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -42.68 43.63 Favored Glycine 0 N--CA 1.453 -0.205 0 O-C-N 123.687 0.617 . . . . 0.0 114.408 -169.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 14.8 tptt -61.81 -39.27 91.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.519 0.676 . . . . 0.0 110.317 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.0 mt-10 -80.81 -35.99 32.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.36 -175.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.444 HD22 ' C ' ' A' ' 48' ' ' THR . 3.9 m120 -63.42 -43.41 97.58 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.565 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 12.6 tpt180 -63.12 -37.38 86.97 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.661 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.83 HD21 HG11 ' A' ' 13' ' ' VAL . 61.6 tp -56.18 -45.09 79.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.633 176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.524 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 57.3 m -71.01 -14.52 62.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.067 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.565 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 9.9 m-85 -65.45 -32.21 73.71 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 172.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.533 ' HB3' HG12 ' A' ' 97' ' ' ILE . 91.1 m-85 -85.74 -39.11 17.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.267 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 95.8 mt -66.84 -19.84 65.81 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.891 177.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.546 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 86.79 12.12 69.46 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.023 174.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -98.55 19.12 15.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.064 0.459 . . . . 0.0 111.894 -174.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.1 p -102.06 160.51 14.45 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -75.74 -4.7 41.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -168.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -124.4 19.55 8.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.12 0.486 . . . . 0.0 110.318 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.74 -178.3 3.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.775 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.69 119.39 18.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.59 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.5 p -74.06 -17.3 60.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.771 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -58.46 -50.5 73.51 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.546 HG23 ' HA3' ' A' ' 60' ' ' GLY . 12.9 tt -75.44 -31.08 23.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.184 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.0 tt -56.3 -55.16 36.82 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.452 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 8.1 p -67.03 -29.62 69.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.072 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.48 -22.74 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.03 0.443 . . . . 0.0 110.41 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.672 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 98.1 t -85.81 -48.81 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.484 175.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.514 HG23 HG23 ' A' ' 37' ' ' ILE . 41.3 p -61.01 -36.91 80.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 71' ' ' SER . 2.1 mpp_? -54.47 -56.07 30.73 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.546 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.672 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 11.8 Cg_exo -71.67 -36.72 6.1 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.579 1.52 . . . . 0.0 112.436 174.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.401 ' HB2' ' HA ' ' A' ' 74' ' ' THR . 3.8 mmt -59.46 -20.52 55.77 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.443 ' HG ' ' HA ' ' A' ' 32' ' ' PHE . 41.1 t -60.8 -13.64 16.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -177.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.3 m -126.45 174.74 9.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -64.89 88.21 0.06 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.787 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 14.1 tpt -103.28 149.58 37.1 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -162.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.787 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 23.4 Cg_exo -41.41 3.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 127.771 5.647 . . . . 0.0 117.978 168.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' A' ' 81' ' ' MET . . . -37.44 -27.52 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -165.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.586 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -53.12 -49.0 67.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.808 0.813 . . . . 0.0 109.476 171.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 82' ' ' PRO . 41.1 mtmt -74.01 -30.41 62.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.315 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.537 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 39.6 mt -60.53 -41.44 87.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.942 -174.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.562 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 43.9 t -63.07 -33.0 74.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.318 0.58 . . . . 0.0 110.93 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.425 ' CD ' ' HB3' ' A' ' 10' ' ' ASP . 69.6 mm-40 -74.81 -36.07 62.47 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.119 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.18 -28.24 66.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.015 175.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.435 ' HA ' HD11 ' A' ' 93' ' ' LEU . 28.8 mt -71.04 -15.77 62.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.302 177.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -69.8 -16.12 63.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 0.0 110.334 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -68.92 -24.95 64.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.6 176.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.435 HD11 ' HA ' ' A' ' 90' ' ' LEU . 7.0 mp -80.91 -53.53 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.719 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.49 ' HB3' HG13 ' A' ' 97' ' ' ILE . 24.2 t70 -164.66 143.16 6.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.846 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.2 p -79.34 -22.75 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -173.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -73.12 -20.29 60.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.533 HG12 ' HB3' ' A' ' 58' ' ' TYR . 10.1 mt -62.97 -33.1 58.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.177 -178.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.615 ' HA ' ' HB2' ' A' ' 14' ' ' CYS . 12.4 p -104.63 -28.45 11.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.855 0.36 . . . . 0.0 110.935 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' A' ' 100' ' ' LEU . 29.4 tt0 -76.12 -94.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.169 -171.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.443 HD12 HD11 ' A' ' 55' ' ' LEU . 25.3 mt 65.71 -63.56 0.21 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.807 0.692 . . . . 0.0 111.948 -177.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 71.01 123.59 0.03 OUTLIER 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.658 0.783 . . . . 0.0 111.192 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.775 176.116 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.447 -1.216 0 CA-C-O 121.077 0.365 . . . . 0.0 111.512 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.75 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -65.73 -34.11 87.89 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.456 -0.878 . . . . 0.0 110.931 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.79 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -176.01 -136.64 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.228 -0.986 . . . . 0.0 108.638 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -121.8 -52.62 2.0 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.616 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 3.1 m -54.8 95.42 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.221 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.526 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 42.0 tp10 -41.14 -58.0 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -168.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.85 HG13 HD21 ' A' ' 55' ' ' LEU . 36.4 t -60.49 -52.36 62.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.131 0.491 . . . . 0.0 111.191 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.724 ' HA ' HD22 ' A' ' 55' ' ' LEU . 3.0 t -62.49 -35.73 80.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.495 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.546 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 3.3 ttmt -56.46 -52.74 63.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.795 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.503 ' N ' ' HG2' ' A' ' 15' ' ' LYS . 55.2 mm-40 -56.57 -48.94 76.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.628 178.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -57.37 -50.44 72.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.747 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 87' ' ' CYS . 98.0 mt -58.83 -55.93 28.72 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -175.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.75 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -66.23 -39.86 89.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.684 0.278 . . . . 0.0 111.311 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 -68.05 -36.38 79.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.697 0.284 . . . . 0.0 110.557 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.94 -46.45 68.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.805 0.812 . . . . 0.0 109.427 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.446 ' O ' HG12 ' A' ' 26' ' ' ILE . 86.1 t80 -48.48 -52.88 20.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.521 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.627 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -74.4 -36.38 63.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.627 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 72.2 m -63.73 -31.81 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.49 HD21 ' ND2' ' A' ' 31' ' ' ASN . 1.1 tp -75.84 -24.01 55.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.768 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 22' ' ' TYR . 45.2 mm -84.07 -37.09 12.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -56.35 -54.9 40.07 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.249 172.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -78.23 -20.5 51.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.838 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.73 28.37 70.94 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.285 174.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.51 HG23 ' HG3' ' A' ' 40' ' ' GLU . 1.0 OUTLIER -100.1 9.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 122.402 1.096 . . . . 0.0 110.073 -176.332 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.49 ' ND2' HD21 ' A' ' 25' ' ' LEU . 2.4 t-20 -88.45 8.33 28.44 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.991 -1.459 . . . . 0.0 112.388 -164.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -108.14 8.4 28.03 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.48 -177.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 37' ' ' ILE . 14.8 m -124.94 118.72 26.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.002 175.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -62.03 -41.17 97.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.268 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -66.1 -29.29 69.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.583 0.706 . . . . 0.0 109.767 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.9 m -76.59 -42.75 41.43 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.522 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 33' ' ' SER . 73.0 mt -58.12 -34.96 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.449 ' O ' HG13 ' A' ' 42' ' ' ILE . 35.7 tt0 -63.86 -52.32 60.58 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.834 178.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -67.5 -36.22 80.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.071 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.51 ' HG3' HG23 ' A' ' 30' ' ' VAL . 8.5 mm-40 -67.36 -38.16 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.382 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.516 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 20.1 tp -60.28 -36.39 77.72 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 38' ' ' GLU . 85.9 mt -67.79 -50.54 59.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.714 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -59.39 -42.77 92.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.408 -179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.35 -32.79 72.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.153 0.501 . . . . 0.0 109.837 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 2.2 t -68.29 -31.87 71.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.327 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.5 tp -85.27 -30.97 23.36 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.266 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -97.1 51.99 1.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.823 0.82 . . . . 0.0 110.551 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.686 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -141.93 -170.13 3.07 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.23 178.073 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HD2' ' N ' ' A' ' 49' ' ' LYS . 10.8 mptt -97.16 166.12 11.73 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.536 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.32 -43.29 19.36 Favored Glycine 0 C--N 1.329 0.187 0 O-C-N 123.876 0.735 . . . . 0.0 114.471 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.672 ' HZ1' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -61.55 -36.33 80.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.103 0.477 . . . . 0.0 110.716 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.686 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.3 mt-10 -85.09 -34.76 22.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.158 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.27 -43.31 96.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 23.2 tpt180 -72.25 -35.2 68.74 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.488 177.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.85 HD21 HG13 ' A' ' 13' ' ' VAL . 57.8 tp -56.35 -39.05 72.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.384 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.701 ' SG ' HG22 ' A' ' 62' ' ' THR . 0.5 OUTLIER -71.28 -15.07 62.41 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.139 -176.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.463 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.1 m-85 -66.32 -34.23 77.51 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.163 0.506 . . . . 0.0 109.665 174.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.492 ' HB3' ' HB ' ' A' ' 97' ' ' ILE . 24.1 m-85 -83.3 -23.77 32.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.712 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.499 ' CD2' HD13 ' A' ' 97' ' ' ILE . 22.5 mt -79.38 -19.33 50.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.15 173.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.588 ' HA2' ' HB3' ' A' ' 65' ' ' ALA . . . 92.78 0.32 69.16 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 113.475 175.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.516 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -60.95 -33.73 73.64 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -172.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.701 HG22 ' SG ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -74.26 -8.37 56.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.403 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm 68.69 -7.16 0.75 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.145 0.578 . . . . 0.0 111.403 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 62' ' ' THR . 19.6 t70 -72.03 -23.96 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.863 0.84 . . . . 0.0 109.245 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.588 ' HB3' ' HA2' ' A' ' 60' ' ' GLY . . . -90.94 -167.52 1.84 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.69 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.64 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -62.84 133.29 54.49 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.091 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.56 -21.3 52.72 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.505 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 6.2 ttpm? -77.85 -26.26 49.26 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.949 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' ' 66' ' ' ALA . 15.0 pt -76.35 -22.87 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 120.964 0.411 . . . . 0.0 110.203 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.34 -48.68 72.16 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.697 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 18.9 m -63.16 -34.17 77.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.218 174.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.416 ' HB3' ' O ' ' A' ' 69' ' ' ILE . 12.4 tp10 -53.74 -33.52 55.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.236 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.69 -53.57 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.324 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.612 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 41.8 p -58.92 -33.56 70.71 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.697 ' HG2' ' O ' ' A' ' 71' ' ' SER . 21.6 mmt180 -64.43 -57.45 17.29 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.214 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.51 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 49.3 Cg_endo -71.11 -15.62 32.07 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.857 1.704 . . . . 0.0 112.74 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.8 mmt -73.05 -19.98 61.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.419 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 37' ' ' ILE . 23.5 t -61.78 -13.61 25.27 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.778 HG13 ' HG3' ' A' ' 81' ' ' MET . 13.3 p -153.48 148.26 13.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -48.07 111.83 0.49 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.041 0.448 . . . . 0.0 110.424 176.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.778 ' HG3' HG13 ' A' ' 79' ' ' VAL . 21.6 mtp -144.7 178.98 1.26 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -166.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.583 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 33.8 Cg_exo -37.43 1.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.189 1 C-N-CA 127.92 5.747 . . . . 0.0 118.535 170.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.568 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.28 -38.35 0.22 Allowed 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.838 1.199 . . . . 0.0 113.892 -170.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.79 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -51.76 -50.33 60.85 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.4 . . . . 0.0 111.128 176.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.657 ' H ' ' HG2' ' A' ' 84' ' ' MET . 6.3 ptmt -88.2 -14.63 38.08 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.237 -0.29 . . . . 0.0 111.377 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.568 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 31.2 mt -59.71 -44.1 92.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.614 0.245 . . . . 0.0 110.846 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.833 ' HB2' HD12 ' A' ' 18' ' ' LEU . 42.6 t -65.89 -21.13 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.276 0.56 . . . . 0.0 111.211 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -82.88 -34.71 26.64 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.0 mttt -62.67 -31.42 72.3 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.478 0.656 . . . . 0.0 109.812 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 74.1 mt -66.74 -14.8 63.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.951 -177.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 41.7 mtpt -67.2 -17.49 64.84 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.698 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -66.15 -29.77 70.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.563 . . . . 0.0 109.689 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 60.1 mt -90.42 -50.22 6.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.101 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.572 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 16.6 t70 -147.71 132.42 17.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.067 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.3 m -87.44 -20.79 26.12 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.1 tp60 -78.89 -30.12 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.739 -174.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.499 HD13 ' CD2' ' A' ' 59' ' ' LEU . 10.3 tt -54.25 -29.18 19.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.854 0.835 . . . . 0.0 110.109 173.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.616 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 45.1 t -86.3 -58.71 2.52 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.624 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -96.17 42.89 1.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.798 -173.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.2 tp -70.57 -56.63 6.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.956 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 69.38 135.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 O-C-N 124.122 0.889 . . . . 0.0 112.016 177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.683 174.903 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.449 -1.117 0 N-CA-C 109.999 -0.808 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.934 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -78.65 -39.87 20.03 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.4 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.718 ' HB3' ' CB ' ' A' ' 87' ' ' CYS . . . -173.67 -90.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.834 0.35 . . . . 0.0 110.347 -176.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -152.58 -71.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.579 ' HB2' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -81.18 146.52 30.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -46.78 -56.79 5.65 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -171.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.824 HG12 HD22 ' A' ' 55' ' ' LEU . 58.7 t -61.13 -50.98 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 117.958 0.345 . . . . 0.0 111.742 -173.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.472 ' HA ' HD23 ' A' ' 55' ' ' LEU . 49.9 t -60.62 -33.87 73.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.525 0.678 . . . . 0.0 109.913 176.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.805 ' HG3' ' HA3' ' A' ' 8' ' ' GLY . 24.0 ttmt -67.17 -48.8 66.88 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.282 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.67 -42.93 84.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.843 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -66.35 -57.01 8.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 80.0 mt -67.18 -39.05 86.35 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.157 -173.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.934 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 27.3 t-20 -68.7 -55.9 9.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -176.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 -64.28 -32.95 74.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.433 0.161 . . . . 0.0 111.433 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -64.12 -47.28 80.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.982 0.896 . . . . 0.0 109.622 174.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 49.8 t80 -57.96 -55.94 28.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.868 -177.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HE2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -71.46 -26.84 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.259 -176.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.408 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 46.1 t -65.91 -47.56 74.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.923 0.392 . . . . 0.0 110.2 176.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -60.07 -48.37 82.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.605 -179.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 22' ' ' TYR . 43.3 mm -62.2 -45.51 98.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.702 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -70.75 -38.13 73.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.374 -177.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HB2' HG11 ' A' ' 30' ' ' VAL . 60.0 mtm180 -76.32 -13.64 60.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 111.726 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.51 38.31 57.85 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.692 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 1.9 p -125.07 91.31 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.295 -0.452 . . . . 0.0 110.042 -176.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -168.88 -170.29 1.14 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.026 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 62.38 35.11 15.17 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.603 ' O ' HG12 ' A' ' 37' ' ' ILE . 47.2 m -155.28 101.15 2.2 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 75' ' ' ARG . 3.2 mm? -47.16 -43.94 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.16 -46.63 85.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.642 . . . . 0.0 110.458 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.6 m -71.14 -35.48 71.71 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.673 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.603 HG12 ' O ' ' A' ' 33' ' ' SER . 14.9 mm -55.4 -34.27 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.089 0.471 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -61.36 -47.79 84.26 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.914 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -66.63 -36.78 83.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.097 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -60.94 -53.28 59.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.494 HD11 ' HA ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -57.42 -41.26 80.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.67 0.271 . . . . 0.0 110.692 177.611 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.01 -44.89 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.592 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.2 m -58.74 -46.32 87.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.024 0.44 . . . . 0.0 110.34 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -76.12 -17.45 59.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.6 t -69.01 -47.83 64.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.835 177.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 46' ' ' LEU . 3.8 mm? -86.47 -31.22 21.47 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -72.09 -22.88 61.28 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.745 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.04 -164.29 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -98.62 173.11 7.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.305 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.89 -47.23 39.89 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 114.659 0.623 . . . . 0.0 114.659 -169.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.9 mptt -60.9 -37.06 80.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 117.153 0.476 . . . . 0.0 110.967 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.745 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 30.6 mt-10 -81.61 -34.79 30.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.888 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 7.1 m120 -65.94 -23.9 66.7 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 9.2 tpp180 -86.92 -35.04 19.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.235 0.54 . . . . 0.0 109.694 172.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.824 HD22 HG12 ' A' ' 13' ' ' VAL . 29.8 tp -60.99 -36.39 79.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.333 -179.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 21.6 p -65.72 -20.29 66.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.332 -178.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 45.7 m-85 -68.64 -30.94 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.479 ' HB3' HG13 ' A' ' 97' ' ' ILE . 91.0 m-85 -85.3 -45.24 12.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.53 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 97' ' ' ILE . 88.9 mt -68.7 -12.61 61.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.564 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.837 ' HA3' HG21 ' A' ' 69' ' ' ILE . . . 77.04 40.49 24.87 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.095 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.54 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . . . -107.57 25.1 11.9 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.613 0.721 . . . . 0.0 110.281 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.1 t -149.03 141.76 24.54 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.295 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -80.04 -3.22 47.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 -174.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -92.88 7.95 41.73 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.16 -161.65 1.11 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.78 109.97 0.58 Allowed 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.443 0.464 . . . . 0.0 109.964 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -15.27 50.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.343 -173.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -66.5 -44.71 81.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.358 . . . . 0.0 110.568 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.837 HG21 ' HA3' ' A' ' 60' ' ' GLY . 16.7 tt -72.29 -21.52 20.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.756 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.1 tt -61.15 -46.9 88.63 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.477 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 8.6 m -66.36 -28.51 68.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.719 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.407 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 8.5 mm-40 -67.65 -58.26 4.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.708 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.578 ' O ' ' HB2' ' A' ' 77' ' ' MET . 60.9 t -62.32 -44.29 99.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.798 0.333 . . . . 0.0 111.6 -173.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.475 ' HA ' HG21 ' A' ' 37' ' ' ILE . 16.4 p -56.59 -32.56 65.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -176.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -61.32 -56.75 30.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.267 -175.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.924 ' HB2' ' HG2' ' A' ' 81' ' ' MET . 72.6 Cg_endo -78.77 -27.49 4.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 121.706 1.604 . . . . 0.0 113.444 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.578 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 0.3 OUTLIER -67.21 -19.21 65.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.801 0.334 . . . . 0.0 110.795 -178.067 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.8 t -68.34 -13.36 62.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.547 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.716 HG21 ' H ' ' A' ' 80' ' ' HIS . 5.9 p -129.23 179.25 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.716 ' H ' HG21 ' A' ' 79' ' ' VAL . 14.9 t-80 -55.02 -67.86 0.24 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 122.501 0.32 . . . . 0.0 110.226 -178.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.924 ' HG2' ' HB2' ' A' ' 76' ' ' PRO . 15.4 tpt 67.39 145.71 0.1 Allowed Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 164.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.838 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 42.5 Cg_exo -43.74 4.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.949 1 C-N-CA 127.661 5.574 . . . . 0.0 118.251 168.399 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.623 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -35.21 -31.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -158.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.813 ' SD ' ' HG3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.75 -45.18 83.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 120.028 1.285 . . . . 0.0 109.997 175.239 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.813 ' HG3' ' SD ' ' A' ' 84' ' ' MET . 90.1 mttt -63.82 -24.2 67.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.148 176.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.749 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 32.7 mt -61.76 -27.38 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.896 -174.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.718 ' CB ' ' HB3' ' A' ' 9' ' ' ALA . 18.6 t -75.59 -31.56 59.99 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.57 176.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.535 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 4.5 mm-40 -63.35 -43.24 98.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.185 173.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 0.0 OUTLIER -68.57 -33.94 74.95 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.415 176.084 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 15.5 mt -64.3 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.283 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 54.2 mtpt -67.33 -17.13 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.072 0.463 . . . . 0.0 110.854 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.407 ' HB3' ' O ' ' A' ' 89' ' ' LYS . 58.0 tttm -76.69 -25.53 53.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.772 175.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.65 -52.54 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.736 175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.648 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 11.7 t70 -139.49 134.19 31.93 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.051 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 m -85.71 -30.36 23.21 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -86.27 -14.82 42.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.587 HD13 HD21 ' A' ' 59' ' ' LEU . 14.5 tt -59.7 -27.61 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.027 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 45.4 t -83.12 -30.93 27.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.679 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.28 -94.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.398 -171.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.64 -68.28 0.12 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.544 0.528 . . . . 0.0 110.582 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp 64.24 117.32 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.668 0.747 . . . . 0.0 111.81 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.509 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 89.5 m-85 . . . . . 0 CA--C 1.518 -0.283 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.894 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.607 ' O ' ' HB3' ' A' ' 84' ' ' MET . 56.7 Cg_endo . . . . . 0 N--CA 1.443 -1.446 0 N-CA-C 110.184 -0.737 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.627 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -73.77 -27.8 66.33 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.119 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 87' ' ' CYS . . . 177.78 -125.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 O-C-N 124.028 0.487 . . . . 0.0 110.624 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -128.41 -63.56 0.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 m -70.17 124.66 24.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.243 171.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.461 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 3.0 mp0 -46.28 -49.16 17.77 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -169.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.883 HG13 HD21 ' A' ' 55' ' ' LEU . 61.5 t -70.11 -46.81 71.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -167.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 12.7 p -66.47 -30.08 70.34 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.627 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 19.6 ttmt -61.27 -54.7 40.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.6 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.626 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 59.9 mm-40 -52.22 -52.29 53.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.081 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -58.8 -55.4 35.56 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.771 -176.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.6 mt -63.07 -44.15 96.58 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.991 -172.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.523 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -65.61 -49.04 70.18 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 123.143 0.277 . . . . 0.0 111.538 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.626 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 10.5 mtm180 -71.33 -35.89 71.37 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.714 -175.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -64.18 -44.09 93.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.487 0.66 . . . . 0.0 109.497 174.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.501 ' O ' HG12 ' A' ' 26' ' ' ILE . 66.7 t80 -54.81 -55.54 29.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.377 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -70.73 -27.63 64.1 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.972 -178.089 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.471 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 51.4 m -63.37 -52.87 59.88 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.744 176.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.691 HD23 HD21 ' A' ' 31' ' ' ASN . 3.1 mp -60.69 -36.59 79.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.484 0.183 . . . . 0.0 111.38 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.4 mm -67.63 -52.53 39.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.72 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -70.83 -35.01 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.664 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.588 ' HB2' HG13 ' A' ' 30' ' ' VAL . 64.2 mtp180 -75.06 -14.49 60.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.021 0.439 . . . . 0.0 111.242 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.66 40.12 85.89 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.526 -0.629 . . . . 0.0 111.526 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.673 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 3.4 p -127.42 56.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-O 122.519 1.152 . . . . 0.0 110.13 -173.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.691 HD21 HD23 ' A' ' 25' ' ' LEU . 12.8 t-20 -143.68 -163.64 1.7 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.583 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.486 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 94.1 m-85 60.73 30.14 19.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.512 0.673 . . . . 0.0 110.879 -176.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 32.7 m -153.15 112.84 3.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.745 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.2 mm? -61.85 -41.28 97.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.34 -172.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.48 -27.29 64.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.153 0.501 . . . . 0.0 110.389 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.0 m -73.88 -45.97 47.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.747 178.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' SER . 45.0 mt -61.32 -34.3 60.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -73.41 -25.52 60.57 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.375 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -85.6 -44.86 12.26 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.063 0.458 . . . . 0.0 110.263 176.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -65.89 -35.77 81.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.596 -176.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 70' ' ' LEU . 16.4 mt -55.96 -40.05 72.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.273 0.559 . . . . 0.0 109.645 172.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 51.4 mt -72.72 -38.39 58.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.397 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 t -75.25 -50.78 15.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.969 0.414 . . . . 0.0 110.73 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -62.83 -30.92 71.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.027 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 61' ' ' ALA . 15.6 m -68.07 -27.85 66.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -89.18 -15.18 34.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.218 0.532 . . . . 0.0 110.507 173.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.32 -22.2 41.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.534 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.764 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -76.94 -168.18 1.01 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.813 179.231 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -93.84 167.97 11.29 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.32 -46.53 35.53 Favored Glycine 0 CA--C 1.517 0.197 0 O-C-N 123.662 0.601 . . . . 0.0 114.442 -171.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -59.35 -38.79 81.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 117.146 0.473 . . . . 0.0 110.33 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.764 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.5 mt-10 -80.37 -36.49 33.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.204 -176.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -59.28 -47.79 84.04 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 174.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -68.13 -37.5 81.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.48 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.883 HD21 HG13 ' A' ' 13' ' ' VAL . 33.8 tp -52.72 -38.6 61.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.088 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 68.5 m -71.87 -15.04 62.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -73.19 -23.11 60.37 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.474 ' HB3' HG13 ' A' ' 97' ' ' ILE . 89.4 m-85 -85.33 -46.7 10.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.55 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.808 ' HA ' HD11 ' A' ' 97' ' ' ILE . 86.9 mt -62.21 -24.66 67.36 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.702 -178.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.76 7.11 61.72 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.626 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.43 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . . . -90.49 59.85 4.43 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.451 0.643 . . . . 0.0 110.822 -178.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.3 t -166.11 146.93 6.57 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.449 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -87.2 24.42 1.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.527 0.68 . . . . 0.0 110.445 -176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -125.72 13.83 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.205 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -141.46 -176.0 4.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.721 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -73.89 88.78 1.84 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.965 0.412 . . . . 0.0 111.155 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -18.84 65.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.801 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -61.28 -21.72 64.2 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 66' ' ' ALA . 10.9 pt -85.44 -14.48 10.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.089 0.471 . . . . 0.0 110.48 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 41' ' ' LEU . 21.8 tp -69.88 -15.42 63.07 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.876 -171.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.408 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 2.8 p -61.12 -29.66 69.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.535 174.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 58.6 mm-40 -63.47 -29.11 70.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.387 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.486 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.2 t -88.41 -56.79 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.192 0.52 . . . . 0.0 111.122 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.408 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 6.6 p -53.14 -47.83 68.39 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.283 -172.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.567 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.4 mpt_? -65.09 -51.78 52.91 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.726 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 45.9 Cg_exo -61.76 -34.96 81.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.549 1.499 . . . . 0.0 113.247 175.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 21.0 mmt -68.08 -13.55 62.29 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.2 t -67.7 -13.47 62.12 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -175.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.513 HG11 ' H ' ' A' ' 80' ' ' HIS . 2.8 p -134.77 -62.23 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.513 ' H ' HG11 ' A' ' 79' ' ' VAL . 12.7 t-80 -176.33 -89.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -173.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.726 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 49.5 mtp 68.11 167.56 0.12 Allowed Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 163.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.735 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 4.9 Cg_endo -44.92 4.02 0.01 OUTLIER 'Trans proline' 0 C--O 1.205 -1.151 1 C-N-CA 127.987 5.791 . . . . 0.0 117.969 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.621 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -34.6 -26.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -148.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.717 ' HE1' ' O ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -54.21 -42.98 70.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 120.471 1.487 . . . . 0.0 109.744 166.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.735 ' HB3' ' HB2' ' A' ' 82' ' ' PRO . 23.9 ttmm -71.1 -17.71 62.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.966 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.621 HD11 ' HA ' ' A' ' 83' ' ' ALA . 66.9 mt -64.84 -25.39 37.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.414 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.587 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 51.0 t -80.32 -30.58 38.15 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.59 173.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 50.8 mt-10 -65.53 -40.65 93.19 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 8.1 tppt? -57.96 -47.51 82.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.74 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 97' ' ' ILE . 16.4 mt -65.67 -24.56 67.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.055 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 39.8 mtpt -69.99 -14.99 62.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.834 -177.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 34.9 pttt -73.94 -22.75 59.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.189 -0.605 . . . . 0.0 109.405 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -87.92 -45.88 9.87 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.913 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 10.5 t70 -142.46 138.02 30.72 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.689 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.2 m -87.02 -28.04 22.85 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -175.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -85.88 -14.23 45.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.114 0.483 . . . . 0.0 110.911 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.808 HD11 ' HA ' ' A' ' 59' ' ' LEU . 18.8 tt -55.02 -27.21 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.089 -175.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.43 ' HA ' ' HB3' ' A' ' 14' ' ' CYS . 15.8 p -85.39 -38.88 18.21 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -169.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.71 ' HG3' ' H ' ' A' ' 100' ' ' LEU . 6.5 pt-20 -79.58 -98.43 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.121 -170.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.71 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 94.5 mt 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 117.841 0.292 . . . . 0.0 110.326 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -49.64 134.98 19.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.53 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.0 110.556 -177.346 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo . . . . . 0 N--CA 1.444 -1.417 0 N-CA-C 111.317 -0.301 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -90.32 -32.46 9.56 Favored Glycine 0 N--CA 1.436 -1.301 0 C-N-CA 119.111 -1.519 . . . . 0.0 111.733 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.734 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -166.21 -81.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.892 0.377 . . . . 0.0 110.232 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -176.48 -47.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.825 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.7 p -66.21 -90.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.357 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.641 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 31.2 tt0 -172.45 -81.68 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.885 HG11 HD23 ' A' ' 55' ' ' LEU . 36.4 t -56.86 -45.08 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 111.488 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.5 t -64.69 -35.42 80.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.852 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 13.3 ptpt -71.82 -37.73 70.28 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.108 0.48 . . . . 0.0 109.717 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.563 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 78.2 mm-40 -58.82 -51.31 70.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.335 178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.38 -55.63 26.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.572 -176.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 86.5 mt -59.79 -43.19 94.54 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.62 0.248 . . . . 0.0 111.506 -174.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.421 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 14.4 t-20 -74.76 -44.01 51.9 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.865 -176.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.563 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 7.0 tpp85 -55.2 -51.2 67.32 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.271 0.557 . . . . 0.0 110.158 175.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CD2' ' SD ' ' A' ' 77' ' ' MET . 29.6 t80 -59.57 -42.63 92.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.659 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.502 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -52.96 -57.01 11.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.513 178.7 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.678 ' HB2' ' HZ2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -76.18 -30.94 58.26 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.755 -173.662 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.5 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 4.8 t -68.34 -36.73 79.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.937 0.399 . . . . 0.0 110.288 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -67.21 -42.95 83.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.43 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -63.69 -43.31 98.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.085 175.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -55.86 -55.53 31.38 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.085 0.469 . . . . 0.0 110.777 177.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.4 mtm-85 -66.78 -17.35 64.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.163 -177.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.51 31.52 33.32 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.583 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.727 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -131.04 100.69 4.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.074 -175.109 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.409 ' CG ' ' H ' ' A' ' 32' ' ' PHE . 2.2 t-20 -168.8 -170.58 1.2 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.409 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 28.9 t80 73.9 -49.57 0.68 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.784 0.834 . . . . 0.0 111.545 176.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 3.9 m -66.95 114.99 6.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.942 0.401 . . . . 0.0 110.317 177.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.653 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -58.39 -45.15 88.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.983 -176.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -28.52 69.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.266 0.555 . . . . 0.0 110.431 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.501 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.3 m -79.78 -45.49 18.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.524 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' SER . 37.4 mt -60.11 -27.93 40.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -64.12 -41.53 97.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.773 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.478 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 18.8 mmmt -74.22 -45.52 47.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.686 0.755 . . . . 0.0 109.981 -179.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.92 -33.45 75.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.743 -1.117 . . . . 0.0 111.769 -174.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.456 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.2 tp -59.8 -29.24 68.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.548 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 81.4 mt -84.48 -50.5 14.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.297 175.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -55.42 -37.93 68.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.981 -178.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -71.63 -33.81 69.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.721 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.621 ' HA ' ' HG1' ' A' ' 48' ' ' THR . 26.6 p -85.41 -13.46 49.28 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 119.926 -0.709 . . . . 0.0 111.52 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.8 tp -86.58 -22.17 26.43 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 170.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -81.99 -23.22 36.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.041 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.779 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -79.89 -172.32 3.32 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.542 -175.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -99.23 173.85 6.59 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.853 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.14 -41.38 38.39 Favored Glycine 0 C--N 1.332 0.308 0 N-CA-C 114.993 0.757 . . . . 0.0 114.993 -169.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.9 tppt? -60.81 -43.54 98.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 0.0 109.955 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.779 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 19.1 mt-10 -80.45 -32.5 37.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.58 -174.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.63 -52.49 64.15 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -63.28 -35.63 81.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.486 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.885 HD23 HG11 ' A' ' 13' ' ' VAL . 52.1 tp -56.52 -33.57 66.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.029 177.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.803 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 51.3 t -70.67 -25.32 62.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.378 -177.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.52 ' CZ ' HG22 ' A' ' 62' ' ' THR . 64.3 m-85 -69.05 -28.14 66.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.207 0.527 . . . . 0.0 109.708 174.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.505 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.1 m-85 -86.83 -34.27 19.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.926 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.3 mt -71.51 -14.87 62.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.826 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.565 ' HA3' HD11 ' A' ' 69' ' ' ILE . . . 91.22 11.85 60.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.899 -0.667 . . . . 0.0 113.744 171.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.803 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -84.02 -43.29 15.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.006 0.403 . . . . 0.0 111.107 -178.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.52 HG22 ' CZ ' ' A' ' 57' ' ' TYR . 1.2 m -64.65 154.41 36.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -178.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.488 ' HZ3' ' HB3' ' A' ' 63' ' ' LYS . 8.6 mtpm? -80.3 49.18 1.09 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.901 0.381 . . . . 0.0 111.659 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.86 46.01 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' CB ' ' HA2' ' A' ' 60' ' ' GLY . . . -148.79 -167.77 2.92 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.169 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.9 123.17 21.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -76.34 -29.82 57.39 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -84.85 -29.75 25.05 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.565 HD11 ' HA3' ' A' ' 60' ' ' GLY . 24.2 pt -68.17 -16.89 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 120.758 0.313 . . . . 0.0 111.287 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.409 HD21 ' O ' ' A' ' 70' ' ' LEU . 3.0 tt -63.23 -37.98 89.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.9 m -68.39 -24.59 64.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.667 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.07 -24.93 65.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.009 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.506 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 59.0 t -87.57 -57.71 4.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 0.0 110.937 175.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.405 HG21 ' CG2' ' A' ' 37' ' ' ILE . 12.4 p -54.61 -54.97 34.48 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -173.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.653 ' HA ' HD11 ' A' ' 34' ' ' LEU . 9.3 mpt_? -54.4 -50.9 82.45 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 123.234 0.334 . . . . 0.0 111.867 -174.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.506 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 32.3 Cg_exo -64.96 -45.39 8.11 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 121.33 1.353 . . . . 0.0 112.707 173.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.429 ' SD ' ' CD2' ' A' ' 21' ' ' PHE . 53.5 ttm -65.25 -13.19 57.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.79 0.329 . . . . 0.0 111.812 -175.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.1 m -58.66 -19.25 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.726 175.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.53 167.65 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 174.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -70.05 110.02 4.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.883 -0.51 . . . . 0.0 110.15 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.732 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 21.9 mmm -130.31 172.94 6.42 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -167.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.732 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.7 Cg_exo -39.19 1.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.824 1 C-N-CA 127.89 5.727 . . . . 0.0 118.68 171.032 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.57 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -39.83 -26.09 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -168.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.734 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.17 -41.3 79.0 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 122.129 0.966 . . . . 0.0 109.269 172.045 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.539 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 29.5 mtpt -85.26 -22.55 28.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.078 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.57 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 58.8 mt -66.93 -33.26 62.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 C-N-CA 120.399 -0.521 . . . . 0.0 109.878 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.486 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 34.6 t -62.63 -31.97 72.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.187 0.518 . . . . 0.0 110.299 173.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 33.8 tt0 -68.5 -34.82 76.56 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.684 177.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.213 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.28 -42.53 30.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.416 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.617 ' HG3' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -69.75 -13.77 62.45 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.819 0.342 . . . . 0.0 110.642 179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -59.72 -37.75 79.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.157 0.503 . . . . 0.0 109.744 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.0 -46.52 18.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.815 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.576 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 15.2 t70 -142.34 108.16 5.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.939 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' SER . . . . . 0.589 ' HA ' ' HB2' ' A' ' 91' ' ' LYS . 13.0 t -73.48 -17.0 61.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.209 -175.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 23.8 mt-30 -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.64 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.505 HG12 ' HB3' ' A' ' 58' ' ' TYR . 84.0 mt -56.79 -48.84 80.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.575 0.702 . . . . 0.0 110.26 173.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.49 -48.87 13.15 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.814 -177.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -87.58 37.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.039 -176.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 13' ' ' VAL . 21.3 tp -74.05 -57.18 4.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 65.13 122.45 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.207 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.462 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 96.6 m-85 . . . . . 0 CA--C 1.518 -0.287 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.269 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.452 -0.943 0 N-CA-C 110.621 -0.569 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.873 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -77.82 -34.72 37.76 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.283 -175.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -169.12 -92.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.931 0.396 . . . . 0.0 111.165 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -155.19 -47.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.259 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -76.12 -107.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.432 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 5.1 tp10 -153.84 -72.97 0.13 Allowed 'General case' 0 C--O 1.219 -0.5 0 O-C-N 122.105 -0.372 . . . . 0.0 111.457 -175.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.679 HG13 HD12 ' A' ' 55' ' ' LEU . 77.7 t -57.75 -55.27 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.563 ' HA ' ' CD1' ' A' ' 55' ' ' LEU . 35.4 t -59.53 -35.44 74.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.479 0.657 . . . . 0.0 110.441 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.529 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 6.3 ttmt -67.7 -46.52 72.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.755 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.571 ' HB3' HH21 ' A' ' 20' ' ' ARG . 26.0 mm-40 -57.41 -53.79 54.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.961 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -56.98 -55.37 35.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.246 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.559 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 69.8 mt -61.44 -55.35 32.29 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 120.533 0.206 . . . . 0.0 111.46 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.873 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 26.3 t-20 -66.47 -45.53 79.41 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.571 HH21 ' HB3' ' A' ' 16' ' ' GLU . 18.6 ttp85 -67.3 -39.04 85.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.438 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -61.33 -46.15 91.47 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 122.308 1.052 . . . . 0.0 109.192 174.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.742 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.2 t80 -55.76 -38.08 69.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 112.864 -1.971 . . . . 0.0 111.974 -175.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -85.46 -28.98 24.67 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.476 178.023 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.591 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 69.0 m -59.9 -40.26 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.886 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.7 mp -69.66 -25.02 63.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.375 179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.0 mm -78.76 -51.61 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.97 -46.4 89.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.177 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.453 ' HB2' HG12 ' A' ' 30' ' ' VAL . 53.2 mtp85 -72.92 -13.64 61.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.009 -177.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.75 45.08 54.65 Favored Glycine 0 C--N 1.332 0.344 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.702 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 6.0 p -138.26 51.21 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 0 CA-C-O 122.378 1.085 . . . . 0.0 109.883 -170.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -130.82 179.96 5.66 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.593 -0.692 . . . . 0.0 111.345 -172.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.578 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 71.0 m-85 72.28 -48.14 0.68 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.978 0.911 . . . . 0.0 112.131 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.473 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 15.0 m -64.43 104.85 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.44 -41.34 72.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.854 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -63.32 -34.15 77.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.597 0.713 . . . . 0.0 110.197 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 85.9 m -79.71 -43.94 21.73 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.259 -178.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 33' ' ' SER . 67.5 mt -59.34 -31.74 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.464 ' HG3' HD23 ' A' ' 70' ' ' LEU . 35.2 tt0 -61.37 -55.13 34.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.812 175.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HA ' HD13 ' A' ' 42' ' ' ILE . 21.9 tptm -67.13 -35.28 79.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.212 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.06 -34.59 73.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.196 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.01 -41.65 96.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 172.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 39' ' ' LYS . 99.0 mt -59.57 -48.67 86.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.735 175.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 t -63.76 -48.71 75.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.891 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.543 ' HZ ' ' HG2' ' A' ' 20' ' ' ARG . 11.3 t80 -63.95 -34.57 78.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.28 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.469 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -60.44 -33.25 72.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.632 176.868 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -86.87 -39.39 15.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.44 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.18 -15.66 60.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.931 -173.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.739 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.97 -171.17 0.83 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.865 0.364 . . . . 0.0 111.466 178.849 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.24 164.34 13.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -47.61 -41.47 18.73 Favored Glycine 0 C--N 1.331 0.253 0 O-C-N 123.661 0.601 . . . . 0.0 114.1 -171.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.718 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -61.05 -43.22 99.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.222 0.534 . . . . 0.0 110.569 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.739 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 21.0 mt-10 -79.04 -30.42 44.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.171 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -63.57 -18.89 64.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 40.6 mmt180 -86.61 -46.27 10.25 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.858 172.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.679 HD12 HG13 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -62.46 -25.13 67.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.775 -174.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.635 ' N ' HD22 ' A' ' 55' ' ' LEU . 25.7 p -72.66 -14.75 61.65 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.255 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.494 ' HA ' ' OG1' ' A' ' 62' ' ' THR . 66.9 m-85 -72.72 -33.72 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.173 0.511 . . . . 0.0 109.626 171.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -85.58 -29.24 24.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.552 HD11 ' HG ' ' A' ' 55' ' ' LEU . 8.1 mp -80.23 -6.04 57.18 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.852 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.522 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 84.43 -0.8 89.24 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.233 176.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.442 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -80.07 42.54 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.148 0.499 . . . . 0.0 111.465 -177.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.494 ' OG1' ' HA ' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -145.17 133.3 21.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.899 -179.232 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.25 -7.7 52.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.74 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -90.5 -18.51 25.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.262 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.71 -160.75 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.377 -175.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.67 132.56 35.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.105 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 p -85.32 -18.09 34.88 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -77.96 -24.07 48.28 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.439 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.522 HG23 ' HA3' ' A' ' 60' ' ' GLY . 17.3 tt -85.09 -23.84 7.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.309 0.576 . . . . 0.0 109.653 173.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.464 HD23 ' HG3' ' A' ' 38' ' ' GLU . 41.1 tp -63.06 -42.7 99.75 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.094 175.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 p -69.17 -15.42 63.4 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.877 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 53.8 mm-40 -77.82 -56.67 4.31 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.672 177.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.45 -34.02 67.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-O 120.973 0.416 . . . . 0.0 111.748 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.407 HG21 HG21 ' A' ' 37' ' ' ILE . 7.6 p -57.33 -27.52 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -74.17 -54.49 3.36 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.861 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.517 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 23.9 Cg_endo -64.74 -17.73 60.4 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.653 1.569 . . . . 0.0 113.195 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.5 mmt -75.69 -16.53 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.473 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.578 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 34.1 t -86.19 -52.77 5.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.861 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.546 HG11 ' HG3' ' A' ' 81' ' ' MET . 7.3 p -109.06 142.34 21.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.011 -176.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.742 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 72.5 m80 -57.15 111.37 1.04 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.844 0.354 . . . . 0.0 110.593 -177.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.546 ' HG3' HG11 ' A' ' 79' ' ' VAL . 32.1 mtp -140.8 170.08 10.24 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -168.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.433 ' C ' HG13 ' A' ' 86' ' ' ILE . 30.1 Cg_exo -41.0 0.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.828 1 C-N-CA 127.623 5.549 . . . . 0.0 118.093 171.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.433 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -38.17 -38.61 0.35 Allowed 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 120.195 1.361 . . . . 0.0 114.522 -169.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.596 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.4 OUTLIER -60.64 -38.17 83.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.891 -0.506 . . . . 0.0 110.766 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 84' ' ' MET . 51.6 mttm -86.25 -22.97 26.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.221 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.433 HG13 ' C ' ' A' ' 82' ' ' PRO . 25.8 mt -62.17 -33.1 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.161 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.559 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 41.8 t -63.86 -36.1 82.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.167 0.508 . . . . 0.0 110.604 174.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.7 mt-10 -66.81 -39.14 87.6 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.703 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -62.38 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.678 175.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.422 ' HA ' HD11 ' A' ' 93' ' ' LEU . 14.6 mt -60.28 -31.59 70.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.595 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.591 ' HB3' ' HZ1' ' A' ' 91' ' ' LYS . 9.5 mtpm? -65.2 -19.31 65.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.25 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.579 ' HZ3' ' HB2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER -77.54 -23.93 50.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 109.789 176.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 90' ' ' LEU . 6.7 mp -84.39 -52.84 5.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.745 175.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -144.16 132.48 21.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.982 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -85.1 -18.45 34.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -174.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.689 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 78.7 mt-30 -67.61 -33.18 74.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.569 0.223 . . . . 0.0 110.644 -178.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 63.5 mt -46.31 -48.96 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.14 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -34.93 15.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.685 -177.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.652 ' HA ' ' HE3' ' A' ' 101' ' ' LYS . 16.3 mm-40 -89.55 21.15 3.55 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -171.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.718 ' HB3' ' HG3' ' A' ' 51' ' ' LYS . 34.0 mt -67.72 -54.22 21.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.443 173.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.652 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 30.0 mmtp 70.18 139.71 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.753 0.787 . . . . 0.0 112.47 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.448 -1.189 0 N-CA-C 111.654 -0.171 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.638 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -77.46 -27.43 59.4 Favored Glycine 0 CA--C 1.507 -0.433 0 C-N-CA 119.316 -1.421 . . . . 0.0 112.088 -171.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 1.01 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -171.29 -97.77 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.756 0.312 . . . . 0.0 110.881 177.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -161.75 176.91 10.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 82.9 m 60.62 -85.57 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 123.213 0.605 . . . . 0.0 111.129 -175.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.792 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 37.0 tt0 -179.61 -76.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.869 HG11 HD21 ' A' ' 55' ' ' LEU . 90.6 t -60.4 -39.58 81.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -167.177 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.589 ' SG ' ' HA ' ' A' ' 98' ' ' CYS . 5.7 p -70.98 -32.21 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.049 178.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.792 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.8 ptmt -73.81 -31.14 63.11 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -177.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.33 -51.81 64.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.147 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.402 ' CE2' ' HD2' ' A' ' 44' ' ' PHE . 44.0 t80 -60.53 -53.19 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.041 -179.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 9' ' ' ALA . 84.7 mt -58.82 -47.61 84.21 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.126 0.266 . . . . 0.0 111.549 -174.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.501 ' HB2' ' CA ' ' A' ' 8' ' ' GLY . 29.0 t-20 -60.2 -49.46 77.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.716 0.293 . . . . 0.0 111.181 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -61.12 -46.06 92.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.275 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -65.83 -47.65 74.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.172 0.511 . . . . 0.0 110.601 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.459 ' O ' HG12 ' A' ' 26' ' ' ILE . 64.1 t80 -51.33 -50.27 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.713 -178.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.827 ' HB2' ' HZ3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -78.52 -33.11 48.2 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.543 -176.583 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.502 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 8.4 t -62.68 -36.02 81.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 0.0 110.786 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.794 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.8 mp -72.91 -27.53 61.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.929 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -76.2 -32.97 23.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.51 -57.13 10.06 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.529 0.68 . . . . 0.0 110.502 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -75.23 -21.43 58.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.486 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.97 45.91 90.9 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.422 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.794 HG22 ' HG ' ' A' ' 25' ' ' LEU . 2.8 m -96.93 4.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.541 0.686 . . . . 0.0 111.461 -173.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' A' ' 33' ' ' SER . 20.9 m120 -82.56 -171.32 3.42 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.972 -170.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 92.7 m-85 71.76 -34.9 0.31 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.502 0.721 . . . . 0.0 111.252 -176.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 16.6 m -88.09 103.02 15.35 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.09 -38.99 80.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.243 -176.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.4 -38.07 85.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.067 0.461 . . . . 0.0 110.674 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 23.0 m -73.7 -46.14 47.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.757 -178.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 33' ' ' SER . 48.1 mt -59.97 -31.63 48.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.476 0.655 . . . . 0.0 109.281 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -70.09 -43.67 70.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.652 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' C ' ' HD3' ' A' ' 39' ' ' LYS . 12.7 tmtt? -66.92 -42.06 86.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.076 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.516 ' HG3' HG23 ' A' ' 30' ' ' VAL . 55.3 mm-40 -67.72 -33.51 75.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.486 -179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.583 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 13.1 mt -54.0 -51.75 62.95 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 170.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.69 -49.78 81.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -58.83 -48.76 80.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.504 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.402 ' HD2' ' CE2' ' A' ' 17' ' ' PHE . 14.7 t80 -67.33 -31.37 71.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.881 0.372 . . . . 0.0 110.187 -175.209 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 62.8 m -64.68 -37.91 89.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.64 177.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.419 ' O ' HD12 ' A' ' 46' ' ' LEU . 2.0 tm? -86.06 -36.46 19.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.131 0.491 . . . . 0.0 110.512 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.33 -22.16 66.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.0 -175.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.744 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -76.76 -169.44 1.27 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.635 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -97.82 175.74 6.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.645 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.91 -40.94 35.74 Favored Glycine 0 CA--C 1.518 0.276 0 O-C-N 123.621 0.576 . . . . 0.0 114.463 -170.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.636 ' HZ1' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -62.2 -50.85 70.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.07 0.435 . . . . 0.0 110.484 -179.648 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.744 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 1.6 mp0 -71.75 -34.23 69.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.621 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -57.44 -45.6 84.5 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -71.61 -37.61 70.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.39 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.869 HD21 HG11 ' A' ' 13' ' ' VAL . 22.9 tp -53.75 -32.59 52.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.555 178.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.634 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 32.6 t -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -176.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.49 -29.76 62.7 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.572 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.444 ' HB3' HG13 ' A' ' 97' ' ' ILE . 87.7 m-85 -74.68 -44.59 49.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.406 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.687 HD21 HD11 ' A' ' 97' ' ' ILE . 77.6 mt -67.28 -27.77 67.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.012 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.401 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 91.56 -9.65 76.61 Favored Glycine 0 C--O 1.225 -0.462 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.756 172.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HB1' ' SG ' ' A' ' 56' ' ' CYS . . . -67.14 -16.16 64.15 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.159 0.48 . . . . 0.0 112.264 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -72.04 138.72 48.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -74.52 47.34 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.24 0.543 . . . . 0.0 111.552 -176.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -132.4 -32.3 1.35 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.516 178.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.12 -161.23 0.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.622 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.484 ' O ' HG21 ' A' ' 69' ' ' ILE . . . -63.32 140.17 58.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 174.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.477 ' HA ' HD11 ' A' ' 70' ' ' LEU . 33.3 p -85.74 -24.49 26.88 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -69.13 -30.05 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.39 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.484 HG21 ' O ' ' A' ' 66' ' ' ALA . 19.5 tt -66.71 -22.6 29.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.779 0.323 . . . . 0.0 110.654 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.477 HD11 ' HA ' ' A' ' 67' ' ' THR . 10.3 mp -61.02 -53.26 59.45 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.635 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 4.4 p -65.92 -34.02 77.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.544 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -58.65 -31.15 67.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.646 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.28 -46.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.991 0.424 . . . . 0.0 110.649 175.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.635 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 46.5 p -59.47 -36.04 75.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 71' ' ' SER . 1.5 mpp_? -58.93 -55.81 42.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.214 -178.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.61 -39.75 20.11 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.266 1.311 . . . . 0.0 112.421 175.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.1 mmt -60.27 -19.5 55.08 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.3 t -62.3 -14.97 44.74 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.578 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -151.47 175.75 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -176.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.578 ' H ' HG22 ' A' ' 79' ' ' VAL . 12.8 m-70 -64.43 122.44 16.75 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.575 ' HE1' ' HD2' ' A' ' 82' ' ' PRO . 43.0 mmm -140.71 167.9 16.18 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -170.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.575 ' HD2' ' HE1' ' A' ' 81' ' ' MET . 76.3 Cg_exo -46.46 0.4 0.02 OUTLIER 'Trans proline' 0 C--O 1.208 -1.016 1 C-N-CA 126.966 5.11 . . . . 0.0 117.3 176.09 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.51 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -35.9 -40.18 0.18 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 -156.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 1.01 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.21 -36.17 68.13 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.672 0.669 . . . . 0.0 110.826 174.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 19.1 mtpp -85.12 -20.43 30.33 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.369 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.51 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 32.7 mt -64.42 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.516 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.681 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 51.6 t -66.42 -22.2 66.22 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.743 177.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.2 mt-10 -75.74 -37.98 58.88 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.592 175.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.59 -30.82 71.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.031 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 93.4 mt -70.09 -14.97 62.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.247 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 30.7 mtpp -67.81 -17.55 64.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.701 0.286 . . . . 0.0 110.645 178.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.728 ' HE3' ' HA ' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -69.51 -28.14 65.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 0.0 109.896 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.417 ' N ' HD13 ' A' ' 93' ' ' LEU . 6.0 mp -88.58 -48.7 7.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.575 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 8.8 t70 -146.44 126.23 13.5 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.9 m -78.21 -26.21 47.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.68 0.276 . . . . 0.0 111.517 -174.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.4 -12.57 51.75 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.598 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.687 HD11 HD21 ' A' ' 59' ' ' LEU . 17.7 tt -48.35 -34.05 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.589 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 30.5 p -82.36 -28.45 31.54 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.102 -176.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -79.18 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.422 -171.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 8.5 mp 64.48 -62.07 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.365 0.666 . . . . 0.0 111.475 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 69.8 mmtt 69.47 129.0 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.39 0.676 . . . . 0.0 111.141 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 80.4 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.049 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.45 -1.051 0 CA-C-O 121.157 0.399 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.669 ' HA3' ' HA ' ' A' ' 15' ' ' LYS . . . -71.92 -23.96 77.26 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.587 -0.816 . . . . 0.0 111.801 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.599 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -167.34 -93.95 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 120.714 0.292 . . . . 0.0 111.565 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -164.16 -32.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.793 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.84 -90.09 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.232 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.562 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 43.3 tt0 -170.81 -76.73 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.72 HG11 HD23 ' A' ' 55' ' ' LEU . 26.4 t -60.32 -46.13 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 111.11 -173.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.587 ' HA ' HD21 ' A' ' 55' ' ' LEU . 45.6 t -63.98 -28.89 70.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.374 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.669 ' HA ' ' HA3' ' A' ' 8' ' ' GLY . 55.1 mtpt -65.1 -50.46 66.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.596 0.712 . . . . 0.0 109.608 174.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.5 mm-40 -54.51 -55.15 32.08 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.371 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.411 ' HB2' HD22 ' A' ' 55' ' ' LEU . 24.4 t80 -58.28 -55.67 31.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.637 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.474 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 92.4 mt -61.98 -48.05 82.1 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -173.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.6 -42.85 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.258 0.551 . . . . 0.0 110.686 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -70.74 -36.84 73.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.203 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -59.36 -45.86 90.25 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -52.68 -56.79 12.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.451 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -25.12 63.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.791 -175.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.579 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 74.4 m -67.76 -56.02 10.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.864 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.66 HD13 HG21 ' A' ' 30' ' ' VAL . 3.9 mm? -61.01 -39.02 88.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.275 -177.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 22' ' ' TYR . 47.4 mm -65.83 -37.29 79.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.867 0.365 . . . . 0.0 110.81 177.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.84 -45.0 65.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.759 ' HG3' HG13 ' A' ' 30' ' ' VAL . 2.8 ptm180 -74.69 -13.6 60.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.905 0.383 . . . . 0.0 111.34 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.52 32.89 14.68 Favored Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.403 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.759 HG13 ' HG3' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -142.37 112.54 2.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -178.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.779 ' HA ' HD11 ' A' ' 37' ' ' ILE . 0.2 OUTLIER -169.12 15.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -179.282 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -125.06 13.68 8.41 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 -174.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.63 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 49.4 m -122.32 124.47 43.8 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.618 HD12 ' HA ' ' A' ' 75' ' ' ARG . 3.6 mm? -68.91 -38.62 79.69 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.45 -15.64 60.41 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.414 0.626 . . . . 0.0 109.79 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.63 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 37.8 m -84.06 -48.2 10.15 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.943 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.779 HD11 ' HA ' ' A' ' 31' ' ' ASN . 33.7 mm -59.44 -29.74 42.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.51 -43.31 93.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.782 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.473 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 14.5 mmmm -83.71 -34.62 24.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.121 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.482 ' HB3' HD11 ' A' ' 25' ' ' LEU . 11.2 mm-40 -66.39 -33.88 76.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.3 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.76 -34.09 72.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.114 0.483 . . . . 0.0 109.845 171.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.616 HG12 ' HA ' ' A' ' 62' ' ' THR . 80.9 mt -73.11 -51.6 25.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.232 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.9 t -58.78 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.755 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -65.57 -35.57 81.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.017 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 25.9 t -65.07 -33.34 75.8 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.87 177.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.6 tp -87.07 -15.93 37.09 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.187 0.518 . . . . 0.0 111.05 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -90.48 -14.96 31.71 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.937 -175.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.77 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -92.37 -169.91 2.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.548 -173.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -94.82 173.62 7.51 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.875 177.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.44 -49.17 33.13 Favored Glycine 0 C--N 1.33 0.242 0 O-C-N 123.821 0.701 . . . . 0.0 114.651 -168.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.766 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 12.6 mptt -61.98 -41.29 97.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.216 0.508 . . . . 0.0 111.127 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.77 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 13.8 mm-40 -68.58 -40.47 80.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.195 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -59.28 -36.52 75.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.48 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -77.62 -37.85 49.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.647 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.72 HD23 HG11 ' A' ' 13' ' ' VAL . 53.3 tp -63.48 -29.5 70.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.154 -174.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 13.4 p -63.59 -27.33 69.17 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.771 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.71 -30.65 71.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 0.0 110.186 175.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.513 ' HB3' HG12 ' A' ' 97' ' ' ILE . 85.1 m-85 -86.48 -22.59 26.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.683 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.431 ' O ' HG22 ' A' ' 73' ' ' VAL . 87.3 mt -106.19 29.63 6.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.861 0.362 . . . . 0.0 111.772 -175.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.564 ' O ' ' HG ' ' A' ' 70' ' ' LEU . . . 63.15 62.97 4.92 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 113.504 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.6 177.62 7.68 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.616 ' HA ' HG12 ' A' ' 42' ' ' ILE . 42.9 p 62.9 148.12 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.492 1.117 . . . . 0.0 112.31 -179.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -84.68 56.43 3.86 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.624 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -163.19 -35.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.165 -175.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.78 -170.42 2.98 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.29 101.85 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.882 0.739 . . . . 0.0 111.056 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -15.42 41.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.262 -169.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -79.35 -46.38 17.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.8 pt -69.8 -14.27 18.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.613 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.2 tt -55.64 -42.8 75.51 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.766 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.593 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 10.8 p -74.23 -28.16 61.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.92 -22.75 62.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.443 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 59' ' ' LEU . 61.7 t -88.07 -55.31 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.044 172.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.467 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 10.6 p -56.06 -43.45 77.92 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.618 ' HA ' HD12 ' A' ' 34' ' ' LEU . 11.5 mpt_? -62.36 -53.02 61.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.35 -177.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.431 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 53.2 Cg_exo -57.94 -38.81 90.79 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.742 1.628 . . . . 0.0 112.803 172.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.5 mmt -58.75 -25.12 62.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.637 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.2 t -63.12 -14.03 43.63 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.607 HG23 ' H ' ' A' ' 80' ' ' HIS . 9.7 p -149.79 175.01 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.607 ' H ' HG23 ' A' ' 79' ' ' VAL . 28.1 m80 -72.62 109.04 5.98 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.764 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 23.7 mmm -125.56 166.9 18.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 121.936 0.874 . . . . 0.0 113.179 -170.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.764 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.1 Cg_exo -39.89 2.95 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.951 1 C-N-CA 128.211 5.94 . . . . 0.0 118.339 169.525 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.499 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -39.17 -32.78 0.11 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -164.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.599 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.3 OUTLIER -61.87 -35.32 77.95 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.388 0.995 . . . . 0.0 110.397 176.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 16.1 ptpt -86.43 -19.59 29.41 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 1.001 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 37.7 mt -61.63 -41.72 91.4 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.327 -179.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.508 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 49.1 t -70.36 -22.32 62.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.322 0.582 . . . . 0.0 110.641 176.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.55 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 17.4 mm-40 -70.13 -26.25 63.86 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 1.001 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 8.5 mtmp? -81.53 -28.99 33.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.494 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.557 ' HA ' HD11 ' A' ' 93' ' ' LEU . 2.8 mm? -63.57 -29.2 70.49 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.474 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 45.2 mttp -55.24 -26.76 41.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.06 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -75.5 -15.55 60.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 90' ' ' LEU . 6.5 mp -91.2 -52.98 4.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.452 176.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.578 ' HB3' HG13 ' A' ' 97' ' ' ILE . 25.6 t70 -158.65 138.7 12.19 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.834 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 43.0 m -85.22 -24.63 27.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.191 -176.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.425 ' HB3' ' OD2' ' A' ' 94' ' ' ASP . 8.1 tt0 -70.37 -22.23 62.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.299 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.578 HG13 ' HB3' ' A' ' 94' ' ' ASP . 36.3 mt -52.69 -45.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.717 0.77 . . . . 0.0 109.733 172.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 -47.27 9.09 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.972 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.22 42.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.461 HD21 HG12 ' A' ' 13' ' ' VAL . 18.4 tp -70.35 -53.91 14.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.836 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 69.4 121.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.602 0.715 . . . . 0.0 112.003 176.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.766 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.4 m-85 . . . . . 0 CA--C 1.52 -0.209 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.023 178.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . 13.9 Cg_exo . . . . . 0 CA--C 1.53 0.313 0 CA-C-O 121.162 0.401 . . . . 0.0 111.622 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.717 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -98.62 -30.14 7.01 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.576 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . 164.38 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 123.907 0.883 . . . . 0.0 109.855 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -110.86 -19.05 12.95 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.966 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 62.3 m -71.28 -0.99 11.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.902 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.857 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 36.5 tt0 72.85 -65.84 0.34 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 114.892 -1.049 . . . . 0.0 113.626 166.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.888 HG13 HD23 ' A' ' 55' ' ' LEU . 57.6 t -62.61 -42.67 96.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.031 -176.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.67 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 29.9 p -74.74 -18.56 60.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.384 175.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.857 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 9.6 ptmt -72.1 -38.16 69.4 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.752 ' HB2' ' HH ' ' A' ' 102' ' ' TYR . 73.3 mm-40 -67.74 -51.82 44.79 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.561 175.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -58.09 -54.94 41.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.552 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.505 HD22 ' HE3' ' A' ' 77' ' ' MET . 91.9 mt -65.83 -32.75 74.45 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 121.33 -0.148 . . . . 0.0 111.208 -175.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.44 ' ND2' ' HD2' ' A' ' 7' ' ' PRO . 3.0 t-20 -71.58 -53.95 12.05 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.069 -0.253 . . . . 0.0 110.909 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 68.9 mtp180 -53.16 -51.0 63.42 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.047 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.77 -50.61 72.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.789 -179.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.638 ' O ' HG12 ' A' ' 26' ' ' ILE . 26.3 t80 -54.45 -55.63 26.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.867 -178.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -69.9 -38.28 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -175.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.7 t -64.31 -27.87 69.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 0.0 110.46 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.811 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 1.4 tp -82.08 -36.31 27.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.31 -176.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.638 HG12 ' O ' ' A' ' 22' ' ' TYR . 44.6 mm -65.41 -49.1 80.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.141 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.0 -42.05 90.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.673 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.524 ' HB2' HG11 ' A' ' 30' ' ' VAL . 81.5 mtm180 -77.34 -12.52 59.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.813 0.34 . . . . 0.0 111.729 -177.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.48 39.61 56.21 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.559 HG13 ' HA ' ' A' ' 25' ' ' LEU . 2.2 p -126.09 27.73 2.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 122.921 1.343 . . . . 0.0 109.444 -170.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.811 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 3.6 t-20 -131.92 99.84 4.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.216 -174.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 3.7 t80 166.13 -28.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.627 1.205 . . . . 0.0 108.507 174.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -82.57 120.85 26.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.219 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.618 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -59.29 -38.58 80.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.619 -175.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.52 -25.67 50.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.005 0.431 . . . . 0.0 110.618 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.481 HG22 HG23 ' A' ' 30' ' ' VAL . 29.7 m -77.69 -44.72 27.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.895 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.467 HD13 ' HA ' ' A' ' 78' ' ' SER . 66.0 mt -61.2 -29.78 46.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.228 0.537 . . . . 0.0 109.688 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -63.1 -54.2 41.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.06 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.2 -41.8 99.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.27 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -69.77 -37.56 76.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.816 -176.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.666 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 25.4 mt -57.12 -43.9 82.8 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 172.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.69 -48.48 88.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.453 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.1 m -69.81 -41.67 74.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.772 0.32 . . . . 0.0 111.845 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.491 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 19.2 t80 -67.47 -34.15 76.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.08 0.467 . . . . 0.0 110.349 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 21.2 m -60.97 -29.88 69.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.664 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 tp -88.3 -26.34 22.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.022 0.439 . . . . 0.0 111.273 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -82.22 -19.09 40.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.423 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -74.61 -173.34 1.77 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.871 -178.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.8 173.34 7.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.909 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.82 -44.33 55.23 Favored Glycine 0 CA--C 1.518 0.273 0 O-C-N 123.502 0.501 . . . . 0.0 114.24 -170.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -59.78 -38.58 82.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.208 0.504 . . . . 0.0 110.667 178.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.5 mt-10 -83.28 -37.51 23.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.936 -175.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -58.04 -45.86 86.29 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.407 ' HD2' ' CD2' ' A' ' 57' ' ' TYR . 40.9 tpt85 -76.43 -30.72 57.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.383 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.888 HD23 HG13 ' A' ' 13' ' ' VAL . 14.9 tp -58.5 -31.0 67.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.002 176.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.694 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 33.9 t -57.36 -30.12 64.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.644 -177.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.407 ' CD2' ' HD2' ' A' ' 54' ' ' ARG . 90.3 m-85 -65.73 -16.72 64.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.971 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.424 ' HB3' HG12 ' A' ' 97' ' ' ILE . 87.5 m-85 -86.28 -48.81 8.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.006 0.432 . . . . 0.0 110.583 175.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 78.6 mt -75.26 -17.35 60.33 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.055 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.49 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 98.92 -108.58 3.61 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -176.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB1' ' SG ' ' A' ' 56' ' ' CYS . . . 50.57 21.82 0.95 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 172.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -140.48 150.99 44.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.139 -178.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -90.54 47.25 1.41 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -151.41 -52.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.921 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.59 104.0 14.85 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.867 -175.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.716 ' O ' HG23 ' A' ' 69' ' ' ILE . . . 49.42 61.19 3.27 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.895 0.747 . . . . 0.0 110.719 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.04 -18.28 56.93 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -167.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.449 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 23.3 ttpp -66.49 -27.83 68.09 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.052 -0.405 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.716 HG23 ' O ' ' A' ' 66' ' ' ALA . 20.4 tt -68.77 -21.82 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -46.12 91.66 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.634 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.1 m -69.0 -30.64 69.08 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.504 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 65.4 mm-40 -66.62 -58.08 5.9 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.372 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.598 ' O ' ' HB2' ' A' ' 77' ' ' MET . 61.4 t -60.76 -44.77 98.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.401 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.9 p -52.92 -35.33 58.23 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -176.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.634 ' HD3' ' O ' ' A' ' 71' ' ' SER . 7.1 mpt_? -63.95 -56.08 27.6 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.487 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.515 ' O ' ' HG3' ' A' ' 81' ' ' MET . 37.8 Cg_endo -70.63 -26.78 23.12 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 121.212 1.275 . . . . 0.0 112.044 173.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.598 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 1.6 tpt -67.0 -19.81 65.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 0.0 110.677 -179.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.467 ' HA ' HD13 ' A' ' 37' ' ' ILE . 67.6 m -73.04 -12.85 61.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.704 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.8 p -130.92 148.87 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.5 m170 -55.42 109.7 0.59 Allowed 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.761 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 26.9 mmm -132.6 164.05 46.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -165.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 32.9 Cg_exo -40.37 3.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.768 1 C-N-CA 128.415 6.076 . . . . 0.0 118.333 169.36 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.473 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.97 -32.83 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.982 2.215 . . . . 0.0 116.982 -159.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.717 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -60.32 -39.49 87.22 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.933 1.242 . . . . 0.0 110.35 173.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 38.2 ttpt -80.56 -14.5 58.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.089 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.473 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 47.5 mt -72.02 -42.79 68.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 46.8 t -69.71 -31.11 68.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.201 0.524 . . . . 0.0 109.607 173.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.432 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 12.0 tp10 -57.42 -48.76 78.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.234 172.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 64.7 mttt -64.9 -29.17 70.1 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 177.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.1 mt -65.56 -14.45 61.12 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.082 -178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.541 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 56.8 mtpt -66.4 -20.33 66.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.58 177.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.584 ' HB3' ' HZ2' ' A' ' 92' ' ' LYS . 3.7 mmmp? -73.16 -21.49 60.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.935 176.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.3 -46.84 5.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.925 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -142.51 119.59 11.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.411 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.4 m -86.74 -13.65 44.68 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.621 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -78.43 -24.77 45.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.708 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.424 HG12 ' HB3' ' A' ' 58' ' ' TYR . 65.4 mt -47.08 -43.26 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.353 179.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.966 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 55.7 m -77.1 -15.67 59.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -168.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.84 39.35 3.54 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.658 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.514 ' HB3' HG23 ' A' ' 13' ' ' VAL . 5.6 mp -74.82 -58.61 3.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 168.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.6 mmtt 68.0 132.95 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.834 0.826 . . . . 0.0 112.815 172.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.752 ' HH ' ' HB2' ' A' ' 16' ' ' GLU . 93.2 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.853 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.448 -1.19 0 N-CA-C 111.413 -0.264 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.628 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -71.26 -34.08 64.36 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.527 -169.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.817 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.52 -90.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.626 0.251 . . . . 0.0 111.16 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -159.32 -73.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.062 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 98' ' ' CYS . 0.6 OUTLIER -84.09 73.28 10.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.657 0.742 . . . . 0.0 112.536 -176.118 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 42.2 mt-10 52.18 -104.17 0.18 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 167.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.599 HG11 HD12 ' A' ' 55' ' ' LEU . 19.0 t -50.17 -51.16 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -161.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.6 t -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.332 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.817 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 7.6 ptpt -72.05 -38.83 69.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 109.913 -178.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.59 -43.51 98.73 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.506 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -62.62 -55.86 23.18 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.366 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.4 mt -62.65 -41.69 99.19 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 121.099 -0.241 . . . . 0.0 111.194 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 2.8 t-20 -62.27 -55.75 25.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.508 0.195 . . . . 0.0 111.399 -176.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.19 -39.12 91.64 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 41' ' ' LEU . 81.3 t80 -65.91 -49.73 66.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.242 0.544 . . . . 0.0 110.648 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.65 ' HE2' ' H ' ' A' ' 81' ' ' MET . 67.7 t80 -54.39 -37.18 64.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.629 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.7 mmmt -81.06 -47.05 14.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.326 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -56.11 -33.57 65.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.194 -176.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.748 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.4 tp -73.65 -33.2 64.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.941 0.4 . . . . 0.0 110.531 -176.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 25.1 mm -79.99 -34.99 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.5 -43.3 99.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.685 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -71.72 -21.09 61.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.91 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.28 22.72 43.31 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.993 -0.623 . . . . 0.0 111.814 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.748 HG22 ' HG ' ' A' ' 25' ' ' LEU . 32.6 m -105.48 -136.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 CA-C-N 115.095 -0.552 . . . . 0.0 109.802 -177.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.452 ' ND2' ' H ' ' A' ' 32' ' ' PHE . 2.5 t-20 74.1 -177.89 0.17 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.374 0.67 . . . . 0.0 111.444 175.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.452 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 53.1 t80 73.87 -57.12 0.63 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.136 0.974 . . . . 0.0 111.453 -177.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.583 ' O ' HG13 ' A' ' 37' ' ' ILE . 4.1 m -67.39 114.32 5.98 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -55.03 -41.12 70.97 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.801 -177.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -39.14 92.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.477 0.656 . . . . 0.0 110.144 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.558 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 22.1 m -74.1 -41.67 61.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.5 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 33' ' ' SER . 61.5 mt -59.39 -33.96 52.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.83 -54.05 26.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.892 177.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -56.92 -52.88 63.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.152 -177.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' OE2' HG21 ' A' ' 30' ' ' VAL . 11.3 mt-10 -74.62 -20.76 59.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.805 -175.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.607 ' HG ' ' HB3' ' A' ' 61' ' ' ALA . 42.5 tp -63.4 -45.56 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.51 -46.9 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.317 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.471 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 58.4 m -55.34 -52.1 64.6 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.461 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -63.82 -44.92 91.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.373 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 8.1 t -64.42 -43.68 93.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.4 mm? -78.44 -14.31 59.43 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.002 0.429 . . . . 0.0 111.003 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.4 -23.03 40.68 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.572 177.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.52 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -74.3 -165.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.797 179.033 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -93.91 170.31 9.65 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.385 -0.197 . . . . 0.0 111.268 -176.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.78 -45.04 61.09 Favored Glycine 0 C--N 1.329 0.188 0 CA-C-N 115.889 -0.596 . . . . 0.0 114.565 -168.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tppt? -59.07 -41.68 88.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.444 0.64 . . . . 0.0 110.328 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.52 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 18.1 mt-10 -77.41 -34.7 54.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.263 -177.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -62.29 -50.41 71.77 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.411 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 13.7 tpt180 -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.102 -0.953 . . . . 0.0 111.18 -177.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.941 HD23 ' HG ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -52.02 -37.96 55.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.84 -179.592 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.762 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 82.0 m -72.19 -14.48 61.81 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.411 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 63.2 m-85 -68.56 -34.34 75.65 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.541 ' CB ' HG12 ' A' ' 97' ' ' ILE . 28.2 m-85 -87.27 -42.3 13.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.422 176.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.941 ' HG ' HD23 ' A' ' 55' ' ' LEU . 31.0 mt -60.95 -34.43 74.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.365 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.618 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 103.65 -7.01 49.45 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.956 -178.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.607 ' HB3' ' HG ' ' A' ' 41' ' ' LEU . . . -76.23 48.2 0.5 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.365 0.602 . . . . 0.0 111.488 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.5 m -155.2 120.67 4.99 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -80.97 41.21 0.57 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.324 0.583 . . . . 0.0 111.091 -175.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -130.43 -6.76 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.268 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.84 -152.43 0.5 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.674 -175.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.41 125.17 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.947 0.403 . . . . 0.0 110.321 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.0 p -80.35 -33.54 37.26 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.066 -172.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 52.8 tttp -66.9 -42.74 84.97 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.368 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.618 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.0 tt -64.68 -28.39 44.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.814 0.34 . . . . 0.0 110.937 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tt -61.06 -47.8 84.67 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 172.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.513 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.7 m -64.51 -34.67 78.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.463 177.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 51.7 mm-40 -62.77 -23.87 67.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.259 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' MET . 59.8 t -87.66 -56.07 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.205 0.526 . . . . 0.0 110.713 172.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.569 HG21 HG22 ' A' ' 37' ' ' ILE . 20.7 p -59.22 -37.04 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -172.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.6 mpt_? -64.53 -54.82 34.17 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.581 -176.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.403 ' HB3' ' HE1' ' A' ' 81' ' ' MET . 13.8 Cg_endo -62.09 -35.16 77.45 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.224 1.283 . . . . 0.0 111.462 173.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.495 ' HB3' HG23 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -62.5 -13.31 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.898 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.486 ' HA ' HD12 ' A' ' 37' ' ' ILE . 29.2 t -62.14 -26.33 68.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.212 0.53 . . . . 0.0 110.476 177.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 8.4 p -123.57 152.9 28.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -58.11 120.34 8.43 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.859 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 1.4 mmt -125.5 149.85 66.05 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -161.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.859 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 66.7 Cg_exo -43.88 2.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.479 0.668 1 C-N-CA 127.27 5.314 . . . . 0.0 116.406 165.04 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 81' ' ' MET . . . -37.98 -22.5 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -158.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.628 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -48.13 -40.6 24.14 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 118.538 0.608 . . . . 0.0 110.223 164.903 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.0 ttpt -87.22 -23.43 24.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.207 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.483 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 60.3 mt -64.36 -33.9 65.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.96 0.409 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.486 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 49.0 t -64.71 -30.16 71.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.4 0.619 . . . . 0.0 110.528 176.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 49.2 mt-10 -73.26 -32.9 64.96 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.927 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.64 -40.54 92.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.38 0.609 . . . . 0.0 109.7 173.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.555 ' HA ' HD11 ' A' ' 93' ' ' LEU . 94.4 mt -69.14 -17.67 63.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.384 -178.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.55 ' HD3' ' SG ' ' A' ' 98' ' ' CYS . 13.9 mmmm -65.26 -21.9 66.79 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.953 0.406 . . . . 0.0 110.664 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -77.45 -27.31 52.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.171 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 90' ' ' LEU . 6.2 mp -83.43 -45.8 13.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.838 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.662 ' HB3' HG13 ' A' ' 97' ' ' ILE . 10.7 t70 -154.09 129.82 10.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.55 177.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.3 t -82.47 -35.61 27.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.019 -176.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.483 ' HA ' ' HB2' ' A' ' 99' ' ' GLU . 27.2 tt0 -69.94 -12.9 61.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.253 -174.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.662 HG13 ' HB3' ' A' ' 94' ' ' ASP . 38.2 mt -43.76 -55.17 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.601 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 26.6 p -91.94 -19.13 22.76 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.669 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 96' ' ' GLN . 42.8 mt-10 -88.71 17.32 5.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.372 -175.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.542 HD12 ' HG ' ' A' ' 55' ' ' LEU . 74.7 mt -62.26 -42.37 99.27 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.425 ' HE2' ' HA ' ' A' ' 99' ' ' GLU . 56.4 mmtt 68.76 141.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.084 0.865 . . . . 0.0 111.605 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.959 176.777 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.428 ' O ' ' HG2' ' A' ' 84' ' ' MET . 2.0 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 CA-C-O 121.221 0.426 . . . . 0.0 111.351 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.913 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -90.46 -35.5 7.39 Favored Glycine 0 N--CA 1.441 -1.022 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.456 -173.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 173.26 -149.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -123.39 -24.44 4.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.483 0.658 . . . . 0.0 109.81 178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 21.2 m -76.55 1.02 17.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.832 -175.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.423 ' CA ' ' HB3' ' A' ' 15' ' ' LYS . 26.4 tp10 69.55 -74.3 0.08 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.942 171.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.667 ' HB ' ' O ' ' A' ' 101' ' ' LYS . 6.6 p -57.83 -46.77 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-O 121.639 0.733 . . . . 0.0 109.727 178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.621 ' HA ' HD23 ' A' ' 55' ' ' LEU . 8.4 t -68.45 -31.67 71.14 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.302 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.578 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 9.9 ttmt -59.24 -53.25 60.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.332 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.596 ' HG3' ' OH ' ' A' ' 102' ' ' TYR . 22.4 mm-40 -55.21 -49.98 70.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.057 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -62.02 -55.04 33.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.576 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.422 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 85.7 mt -56.7 -53.84 53.1 Favored 'General case' 0 C--O 1.223 -0.295 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -173.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.913 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.3 t-20 -67.44 -40.09 85.41 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.397 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.56 HH22 HG21 ' A' ' 48' ' ' THR . 35.6 mtp180 -65.03 -43.34 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.588 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.518 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 55.0 t80 -64.37 -47.27 79.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.3 0.572 . . . . 0.0 109.829 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -51.57 -42.17 61.67 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.648 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.5 mmmt -84.09 -37.76 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.508 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -60.5 -32.27 71.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.156 -178.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 22.9 mt -70.56 -27.92 64.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.022 0.439 . . . . 0.0 110.77 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 27.9 mm -80.18 -48.68 19.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.38 -44.91 95.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.452 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HB2' HG12 ' A' ' 30' ' ' VAL . 62.8 mtp180 -79.43 -13.79 59.36 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.09 28.76 59.81 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.046 178.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.434 HG23 ' HG3' ' A' ' 40' ' ' GLU . 1.4 p -124.23 92.97 2.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.171 0.51 . . . . 0.0 109.858 -175.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -158.87 178.62 9.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.855 -174.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.6 t80 75.91 -55.39 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.462 1.105 . . . . 0.0 112.301 175.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.729 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 8.6 m -60.79 118.39 6.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.083 0.468 . . . . 0.0 110.91 -177.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.27 -41.72 89.52 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.578 -174.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.61 -26.14 60.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.729 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 18.7 m -74.77 -45.49 43.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.302 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.601 HG21 ' HA ' ' A' ' 74' ' ' THR . 21.9 mm -58.45 -34.29 50.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.41 -52.18 59.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.75 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.733 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -57.42 -37.31 72.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.775 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.434 ' HG3' HG23 ' A' ' 30' ' ' VAL . 59.1 mm-40 -85.13 -28.63 25.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.849 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.44 -42.5 92.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.1 mt -61.48 -52.19 64.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.843 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -65.04 -44.71 88.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.955 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -70.84 -27.02 63.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.47 . . . . 0.0 110.287 -176.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.5 t -62.95 -25.66 68.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.981 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -85.83 -37.5 19.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.47 56.41 3.57 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.563 0.697 . . . . 0.0 110.365 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.762 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -153.99 -173.4 4.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.487 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -97.35 171.89 8.12 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.416 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.21 29.9 Favored Glycine 0 C--N 1.331 0.252 0 O-C-N 123.603 0.565 . . . . 0.0 114.039 -173.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.744 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 0.6 OUTLIER -56.98 -43.87 82.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.951 0.405 . . . . 0.0 110.888 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.762 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 12.5 mt-10 -82.64 -32.84 28.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.97 -176.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -61.04 -37.1 81.4 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 18.7 tpt180 -82.07 -32.61 30.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.071 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.828 ' HA ' ' CZ ' ' A' ' 58' ' ' TYR . 34.9 tp -50.08 -46.94 53.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.236 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' SG ' HG23 ' A' ' 62' ' ' THR . 1.6 p -63.72 -17.78 63.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.722 -174.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.8 m-85 -62.75 -51.0 68.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.828 ' CZ ' ' HA ' ' A' ' 55' ' ' LEU . 1.8 p90 -87.32 -17.52 32.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.23 -175.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.2 mt -78.08 -31.1 49.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.416 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 106.27 91.31 2.21 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.872 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . . . -160.06 -53.48 0.05 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.115 0.484 . . . . 0.0 110.044 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.505 HG23 ' SG ' ' A' ' 56' ' ' CYS . 2.9 p -82.3 139.35 34.22 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.58 178.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -81.81 6.35 15.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -90.17 5.8 45.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.539 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.54 -152.06 0.4 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.888 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.26 110.88 2.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.153 0.501 . . . . 0.0 110.908 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.9 p -84.99 -19.01 32.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.456 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -71.96 -47.33 53.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.232 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.512 HD13 HD21 ' A' ' 90' ' ' LEU . 14.5 tt -65.83 -16.94 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.11 -176.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.3 tt -54.17 -46.32 72.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.329 0.585 . . . . 0.0 109.624 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 m -67.89 -25.13 65.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.791 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -73.51 -18.17 61.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.408 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 44.5 t -88.54 -47.67 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.166 0.507 . . . . 0.0 110.848 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.601 ' HA ' HG21 ' A' ' 37' ' ' ILE . 55.9 p -59.06 -39.6 82.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.453 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.3 OUTLIER -61.31 -55.52 42.77 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.827 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.688 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 11.8 Cg_endo -61.05 -42.09 39.05 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 121.223 1.282 . . . . 0.0 112.742 177.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mmt -64.28 -20.69 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.676 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 33.6 t -60.36 -27.26 67.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.485 178.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.896 HG12 ' H ' ' A' ' 80' ' ' HIS . 4.7 p -127.5 -87.32 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.001 178.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.896 ' H ' HG12 ' A' ' 79' ' ' VAL . 39.3 m80 -150.69 -80.06 0.12 Allowed 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 177.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 35.1 mtp 68.81 167.4 0.12 Allowed Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 168.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.562 ' HB2' HG13 ' A' ' 86' ' ' ILE . 18.4 Cg_exo -40.65 -0.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.218 1 C-N-CA 127.553 5.502 . . . . 0.0 118.977 177.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.569 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -34.73 -46.23 0.28 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -156.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.686 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -52.13 -53.71 39.38 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.327 1.06 . . . . 0.0 109.644 174.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.485 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 34.2 tttp -76.29 -18.02 59.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.046 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.972 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 20.1 mt -60.67 -40.57 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 O-C-N 122.136 -0.352 . . . . 0.0 110.255 175.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.422 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 14.8 t -67.04 -19.98 65.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.172 0.51 . . . . 0.0 110.698 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 41.5 mt-10 -78.65 -40.23 34.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.448 0.642 . . . . 0.0 109.836 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.972 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.2 mtmp? -67.83 -30.78 70.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.115 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.512 HD21 HD13 ' A' ' 69' ' ' ILE . 18.6 mt -66.81 -17.2 64.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.571 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.596 ' HG2' ' HB2' ' A' ' 98' ' ' CYS . 45.1 mtpt -68.71 -14.31 62.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.319 -177.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 89' ' ' LYS . 34.0 mtmm -62.04 -39.27 91.77 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.014 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 94' ' ' ASP . 5.9 mp -91.01 71.73 6.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.58 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 27.9 m-20 72.06 105.21 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.012 -175.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.2 m -70.42 -13.54 62.17 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.029 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -49.83 -34.41 19.71 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.926 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.571 HG23 ' HD2' ' A' ' 58' ' ' TYR . 73.3 mt -52.66 -31.14 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.536 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.651 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 5.0 t -86.54 -18.69 30.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.631 -173.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -111.12 52.38 0.74 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.439 0.638 . . . . 0.0 111.322 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.531 HD23 ' OH ' ' A' ' 58' ' ' TYR . 1.5 mp -103.02 -45.05 5.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.889 169.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.667 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 29.6 mmtp 64.33 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.248 -178.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.744 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.4 m-85 . . . . . 0 C--N 1.326 -0.445 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 N--CA 1.445 -1.359 0 N-CA-C 111.117 -0.378 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.871 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -72.33 -37.95 58.79 Favored Glycine 0 N--CA 1.439 -1.112 0 C-N-CA 119.601 -1.285 . . . . 0.0 111.936 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.981 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -173.7 -83.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.413 -176.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -162.67 -67.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.816 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.4 m -57.52 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.679 0.612 . . . . 0.0 112.084 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.472 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 4.4 tp10 -170.35 -75.98 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.495 0 O-C-N 122.063 -0.398 . . . . 0.0 111.055 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 100' ' ' LEU . 38.9 t -55.6 -43.06 71.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.712 0.767 . . . . 0.0 109.968 179.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.535 ' HA ' HD23 ' A' ' 55' ' ' LEU . 37.1 t -61.2 -36.16 79.12 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.172 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.623 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 3.2 ptpp? -77.91 -32.84 51.96 Favored 'General case' 0 N--CA 1.458 -0.052 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.11 -177.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 56.9 mm-40 -57.84 -52.5 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.523 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.78 -55.16 32.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.336 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.435 HD12 ' HB2' ' A' ' 9' ' ' ALA . 82.9 mt -61.37 -46.08 91.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 121.335 -0.146 . . . . 0.0 111.207 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.871 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.4 t-20 -62.06 -52.95 61.86 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.987 0.179 . . . . 0.0 111.327 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.555 ' NH2' HG22 ' A' ' 48' ' ' THR . 51.1 mtm-85 -65.4 -41.86 93.21 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.562 -177.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -59.05 -49.13 79.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.831 0.824 . . . . 0.0 109.584 178.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.531 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 70.0 t80 -53.73 -55.35 27.04 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.256 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -67.39 -34.02 76.41 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.7 m -62.3 -33.9 75.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.933 0.397 . . . . 0.0 111.271 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.735 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.6 mp -77.46 -39.83 45.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.35 -45.84 92.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.246 0.546 . . . . 0.0 109.772 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.71 -51.53 68.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.569 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.705 ' HB2' HG11 ' A' ' 30' ' ' VAL . 90.2 mtm-85 -78.25 -13.47 59.84 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.8 25.87 68.51 Favored Glycine 0 CA--C 1.509 -0.322 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 -176.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.735 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 4.0 p -109.28 57.91 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 122.425 1.107 . . . . 0.0 109.683 -173.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.7 t-20 -140.7 -179.09 5.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.06 -172.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.451 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 44.8 t80 73.09 -55.84 0.67 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.254 1.021 . . . . 0.0 111.329 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.484 ' O ' HG13 ' A' ' 37' ' ' ILE . 22.3 m -60.52 109.75 1.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.834 0.349 . . . . 0.0 110.644 178.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.614 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.3 mm? -59.66 -38.88 82.67 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.858 -175.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -61.15 -38.39 86.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.311 0.577 . . . . 0.0 110.626 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 m -76.43 -41.65 46.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.196 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 33' ' ' SER . 61.1 mt -60.44 -32.3 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.13 -50.56 69.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.509 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.1 tptt -62.95 -35.2 79.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.844 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -74.2 -36.74 64.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.67 -178.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.439 HD13 HG22 ' A' ' 74' ' ' THR . 17.1 mt -58.36 -38.78 77.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 172.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.749 HG12 ' HA ' ' A' ' 62' ' ' THR . 96.1 mt -65.43 -49.3 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.905 176.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -63.64 -55.36 24.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.031 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -61.68 -29.45 70.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.666 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.539 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.5 t -54.23 -50.77 66.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 175.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.1 mt -88.42 -14.57 37.68 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.812 0.339 . . . . 0.0 111.833 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -94.93 -1.74 51.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 111.385 -174.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.768 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -85.58 -161.71 0.64 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.856 177.025 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -93.87 169.54 10.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.612 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -46.73 -52.24 11.68 Favored Glycine 0 N--CA 1.453 -0.176 0 O-C-N 123.769 0.668 . . . . 0.0 114.26 -170.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -63.72 -39.93 95.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.244 0.522 . . . . 0.0 110.821 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.768 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 50.3 mt-10 -72.21 -31.19 65.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.515 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 12.9 m120 -66.79 -21.05 66.05 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.667 175.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.612 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 7.0 mmm180 -86.01 -44.6 12.18 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.555 HD11 HG21 ' A' ' 97' ' ' ILE . 27.8 tp -59.58 -24.87 64.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.427 -1.26 . . . . 0.0 112.598 -172.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 7.6 p -63.84 -34.85 78.85 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.536 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -74.84 -17.09 60.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.147 0.498 . . . . 0.0 110.003 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.522 ' HB3' HG12 ' A' ' 97' ' ' ILE . 63.0 m-85 -85.41 -51.59 6.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.759 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.29 -46.65 89.42 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.962 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.549 ' O ' ' HA ' ' A' ' 70' ' ' LEU . . . 131.9 59.78 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.968 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.409 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . . . -128.85 169.53 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.749 ' HA ' HG12 ' A' ' 42' ' ' ILE . 16.9 p 66.21 142.66 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.295 1.038 . . . . 0.0 111.65 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.555 ' HZ1' ' HB3' ' A' ' 63' ' ' LYS . 9.3 mtpm? -90.73 19.05 5.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -93.12 -27.81 16.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.814 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.81 -167.28 1.39 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.273 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.73 119.93 5.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.055 0.455 . . . . 0.0 110.991 178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.26 -16.16 44.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.667 -176.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 27.5 ttpp -62.73 -51.94 65.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.35 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.451 HD12 ' HB2' ' A' ' 72' ' ' GLU . 8.5 tp -65.88 -25.73 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' A' ' 60' ' ' GLY . 2.8 tt -61.4 -45.08 95.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.482 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 45.3 m -66.68 -35.14 79.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.304 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.451 ' HB2' HD12 ' A' ' 69' ' ' ILE . 42.4 mt-10 -68.86 -23.42 64.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.756 -177.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.492 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 91.6 t -88.01 -48.53 15.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.774 0.321 . . . . 0.0 111.371 174.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.439 HG22 HD13 ' A' ' 41' ' ' LEU . 7.9 p -54.02 -47.27 71.7 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -176.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.614 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.1 mpt_? -58.09 -53.29 67.45 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.745 -177.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.527 ' CA ' ' HG3' ' A' ' 81' ' ' MET . 52.7 Cg_exo -56.74 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.78 1.654 . . . . 0.0 113.1 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.5 mmt -62.69 -14.05 39.47 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.823 0.344 . . . . 0.0 111.749 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 31.5 t -74.27 -14.87 60.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.262 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.665 HG21 ' H ' ' A' ' 80' ' ' HIS . 4.4 p -136.18 -178.15 2.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.665 ' H ' HG21 ' A' ' 79' ' ' VAL . 60.0 t-80 -56.09 -64.29 0.91 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 117.869 0.304 . . . . 0.0 110.336 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER 67.04 146.39 0.11 Allowed Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 51.7 Cg_exo -41.87 0.99 0.0 OUTLIER 'Trans proline' 0 C--O 1.21 -0.878 1 C-N-CA 126.838 5.025 . . . . 0.0 117.723 167.039 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.583 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.1 -34.53 0.06 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -159.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.981 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 1.1 mpp? -55.88 -56.64 18.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.872 0.844 . . . . 0.0 109.559 171.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 82' ' ' PRO . 44.4 mttm -68.54 -19.87 64.52 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.616 -1.174 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.583 HD12 ' HA ' ' A' ' 83' ' ' ALA . 24.7 mt -60.87 -29.63 45.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.046 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.532 ' CB ' ' HB3' ' A' ' 9' ' ' ALA . 46.0 t -72.04 -34.34 68.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.428 0.632 . . . . 0.0 110.026 176.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.563 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 51.0 mt-10 -69.09 -41.12 77.91 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.681 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -76.11 -28.21 57.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.669 177.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mt -67.63 -28.15 67.48 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.995 176.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.563 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 25.7 mtpp -60.75 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.958 176.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -79.15 -13.89 59.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.374 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.2 mp -100.21 -49.57 4.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.647 174.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -142.09 118.78 11.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.906 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.2 p -85.65 -15.11 43.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.798 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.403 HE21 ' HB2' ' A' ' 96' ' ' GLN . 16.1 mt-30 -71.13 -29.99 65.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.555 HG21 HD11 ' A' ' 55' ' ' LEU . 95.4 mt -50.87 -40.36 20.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.907 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.402 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 49.6 t -71.36 -52.26 19.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.357 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -97.2 36.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.717 -171.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.591 ' O ' HG23 ' A' ' 13' ' ' VAL . 10.1 tp -84.65 37.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -54.02 145.54 16.51 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.351 -173.449 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo . . . . . 0 N--CA 1.456 -0.73 0 CA-C-O 121.208 0.42 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.748 ' H ' ' HD3' ' A' ' 15' ' ' LYS . . . -73.08 -42.64 43.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.107 -176.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.645 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -166.92 -82.68 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.175 0.512 . . . . 0.0 110.963 -172.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -162.16 -62.53 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.319 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 14' ' ' CYS . 4.8 p -77.76 148.13 34.98 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.24 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.574 ' HA ' ' HZ1' ' A' ' 15' ' ' LYS . 40.5 tt0 -58.91 -72.08 0.11 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -172.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.824 HG21 HD22 ' A' ' 55' ' ' LEU . 6.1 p -51.38 -48.65 33.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -170.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.456 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 33.9 t -62.97 -43.18 99.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.924 0.392 . . . . 0.0 110.877 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.748 ' HD3' ' H ' ' A' ' 8' ' ' GLY . 5.2 ptpp? -72.32 -42.13 65.75 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.578 -175.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.604 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 37.0 mm-40 -57.88 -42.73 85.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.535 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -60.0 -51.46 69.57 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.418 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.5 mt -60.34 -45.04 94.87 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -50.92 -56.39 12.58 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 123.52 0.512 . . . . 0.0 112.109 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.615 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -58.67 -55.24 37.65 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.719 -177.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 69.2 t80 -59.08 -48.22 82.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.203 0.525 . . . . 0.0 111.073 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -53.3 -48.41 68.41 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.188 -174.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HB2' ' NZ ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -85.69 -39.26 17.42 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.504 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -61.96 -32.44 72.87 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.761 0.315 . . . . 0.0 111.356 -178.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.746 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 11.5 tp -61.63 -41.94 98.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.307 0.575 . . . . 0.0 109.992 177.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.3 mm -75.26 -38.06 40.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.455 -177.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.14 -45.91 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.596 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -70.08 -23.7 63.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.051 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.36 -5.58 67.84 Favored Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.985 -0.626 . . . . 0.0 111.657 174.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.746 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -86.48 122.41 38.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.048 -0.576 . . . . 0.0 110.201 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.412 HD21 ' HA ' ' A' ' 31' ' ' ASN . 1.3 t-20 -172.03 -177.99 2.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 174.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.455 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 94.9 m-85 71.19 -58.36 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.628 0.771 . . . . 0.0 112.145 178.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 37' ' ' ILE . 12.5 m -64.2 109.07 1.74 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.847 0.356 . . . . 0.0 110.15 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.577 HD13 ' HA ' ' A' ' 75' ' ' ARG . 2.6 mm? -59.86 -37.74 80.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.874 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.08 -36.57 82.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.54 0.686 . . . . 0.0 110.045 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.417 HG22 ' CG2' ' A' ' 30' ' ' VAL . 56.6 m -80.09 -38.78 31.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.49 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 33' ' ' SER . 72.1 mt -62.89 -34.75 67.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -72.96 -38.74 66.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.554 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -58.49 -47.73 83.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 175.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.507 ' HG3' HG22 ' A' ' 30' ' ' VAL . 6.7 mm-40 -68.47 -41.42 80.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.526 -176.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.557 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 13.6 mt -55.79 -44.9 78.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 175.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.456 HD11 ' HD3' ' A' ' 63' ' ' LYS . 69.1 mt -62.7 -52.41 60.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.138 178.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.1 m -58.94 -47.34 85.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.959 0.409 . . . . 0.0 111.21 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.615 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 30.2 t80 -65.84 -36.25 82.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.746 -176.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.577 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 6.5 m -69.33 -33.29 72.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.8 mt -85.29 -31.7 22.92 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.373 -0.531 . . . . 0.0 109.938 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.25 70.02 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.72 0.771 . . . . 0.0 110.305 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.441 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -159.1 -162.33 1.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.284 177.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.64 170.41 9.35 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.286 -0.566 . . . . 0.0 111.145 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.53 -48.37 60.8 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.174 -169.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.791 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 11.5 mptt -67.44 -25.74 66.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.448 0.624 . . . . 0.0 111.562 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.441 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 36.5 mt-10 -77.97 -49.38 14.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -58.16 -40.59 81.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.467 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 54' ' ' ARG . 27.2 tpt85 -69.97 -40.35 75.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.214 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.824 HD22 HG21 ' A' ' 13' ' ' VAL . 43.8 tp -61.25 -34.09 74.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.092 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 64.4 m -68.41 -14.71 63.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -67.7 -29.32 68.55 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -85.54 -39.3 17.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.092 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.552 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 66.8 mt -67.33 -31.93 72.54 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.183 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.5 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 109.31 -18.13 30.79 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.873 176.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB1' ' SG ' ' A' ' 45' ' ' CYS . . . -80.58 67.46 6.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.457 0.646 . . . . 0.0 111.393 -177.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.466 HG23 ' H ' ' A' ' 64' ' ' ASP . 25.0 m -155.15 145.7 22.17 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.456 ' HD3' HD11 ' A' ' 42' ' ' ILE . 31.9 mmmt -76.46 2.97 12.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.261 0.553 . . . . 0.0 110.858 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.466 ' H ' HG23 ' A' ' 62' ' ' THR . 19.9 m-20 -125.27 29.34 6.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.334 171.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.409 ' HB2' ' HB ' ' A' ' 62' ' ' THR . . . -133.28 170.84 14.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.464 -178.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.51 117.46 18.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.047 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.481 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . 39.7 p -73.37 -14.1 61.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.712 -178.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -58.67 -56.33 23.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.62 0.248 . . . . 0.0 110.728 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.5 HG22 ' HA3' ' A' ' 60' ' ' GLY . 14.5 tt -69.23 -25.73 30.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.042 0.449 . . . . 0.0 110.377 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.481 ' HB3' ' HA ' ' A' ' 67' ' ' THR . 20.2 tp -60.24 -48.67 80.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.686 174.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.566 ' HA ' ' HG1' ' A' ' 74' ' ' THR . 20.8 m -66.05 -29.28 69.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.41 -21.43 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.965 175.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.517 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 57.3 t -87.65 -45.0 16.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.809 0.338 . . . . 0.0 111.35 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.566 ' HG1' ' HA ' ' A' ' 71' ' ' SER . 28.7 p -57.72 -41.5 81.88 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.577 ' HA ' HD13 ' A' ' 34' ' ' LEU . 10.5 mpt_? -59.01 -54.97 51.22 Favored Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.611 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 50.5 Cg_exo -56.6 -43.13 58.03 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.946 1.764 . . . . 0.0 113.24 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.3 mmt -62.91 -13.75 38.25 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.455 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 40.6 t -69.64 -12.31 61.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.574 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.794 HG21 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -153.73 -166.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.794 ' H ' HG21 ' A' ' 79' ' ' VAL . 36.4 t-80 -60.54 -71.8 0.13 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.886 0.312 . . . . 0.0 110.911 -176.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.749 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 48.8 mmm 64.24 158.0 0.12 Allowed Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 170.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.749 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 52.1 Cg_exo -41.26 1.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.033 1 C-N-CA 128.4 6.067 . . . . 0.0 118.92 172.257 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.644 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -38.39 -24.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -162.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.637 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -67.96 -58.88 3.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.44 1.018 . . . . 0.0 109.963 173.233 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 64.0 pttt -76.62 -12.14 59.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 -176.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.661 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 16.8 mt -54.52 -35.23 31.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 173.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 48.8 t -71.34 -29.11 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.166 0.508 . . . . 0.0 110.319 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.635 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 9.0 tp10 -70.8 -38.5 73.34 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.562 0.696 . . . . 0.0 109.144 174.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.661 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.09 -20.94 64.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.119 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.48 HD22 HD11 ' A' ' 69' ' ' ILE . 79.9 mt -78.87 -34.18 45.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.958 173.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 48.7 mtpt -62.91 -27.3 69.28 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.449 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -60.02 -29.23 68.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.627 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -96.4 -50.88 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.086 0.47 . . . . 0.0 110.258 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.648 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 12.5 t70 -134.57 123.5 23.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.3 m -86.2 -15.28 41.41 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -86.07 -25.66 25.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.171 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.557 HG22 ' O ' ' A' ' 94' ' ' ASP . 14.7 tt -55.47 -31.52 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 121.198 0.523 . . . . 0.0 110.89 178.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.502 ' SG ' ' HD2' ' A' ' 91' ' ' LYS . 6.6 t -75.7 -55.73 5.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.364 0.602 . . . . 0.0 109.509 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -91.07 49.48 1.64 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.225 -176.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.587 ' HB3' HG12 ' A' ' 13' ' ' VAL . 0.6 OUTLIER -76.23 -47.85 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 176.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.591 ' H ' HG12 ' A' ' 13' ' ' VAL . 71.2 mmtt 66.37 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.532 0.733 . . . . 0.0 111.687 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . 0.791 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 96.9 m-85 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.576 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.479 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 4.8 Cg_endo . . . . . 0 N--CA 1.455 -0.781 0 CA-C-O 121.113 0.38 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.694 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -75.87 -26.96 63.54 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.33 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.475 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . 177.12 -130.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 123.337 0.655 . . . . 0.0 109.421 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -132.81 -47.2 0.87 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.84 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 48.2 m -77.69 21.25 0.3 Allowed 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.646 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 34.3 tt0 71.4 -67.56 0.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 174.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.772 HG12 HD23 ' A' ' 55' ' ' LEU . 43.8 t -63.28 -55.66 21.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -170.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.742 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.4 p -64.33 -31.1 72.17 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.646 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 12.7 ttmt -58.88 -53.9 53.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.5 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.459 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 50.2 mm-40 -49.68 -54.67 17.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.655 176.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.32 -54.4 47.39 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.092 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.787 HD11 ' HB2' ' A' ' 87' ' ' CYS . 96.3 mt -57.44 -53.93 52.61 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.694 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -70.61 -43.36 69.47 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.854 -173.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.556 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 46.7 mtp180 -61.33 -41.23 96.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.195 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.407 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 41.1 t80 -59.47 -49.25 78.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.968 0.889 . . . . 0.0 109.631 175.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.579 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 25.7 t80 -58.05 -55.57 33.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.762 -1.563 . . . . 0.0 111.801 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -67.14 -27.72 67.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.714 0.293 . . . . 0.0 110.997 -176.149 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.478 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 17.0 t -68.82 -46.13 69.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.599 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -56.85 -52.84 63.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.913 -179.57 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.55 -40.29 88.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.386 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -69.28 -40.24 77.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.033 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -62.55 -31.53 72.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.965 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.3 8.92 40.14 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 174.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.511 HG21 ' N ' ' A' ' 31' ' ' ASN . 5.1 m -89.59 -154.98 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.964 -0.618 . . . . 0.0 109.539 179.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 1.083 ' HA ' HD12 ' A' ' 37' ' ' ILE . 22.9 t-20 78.94 91.55 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.747 0.784 . . . . 0.0 112.984 168.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 17.8 t80 166.45 -30.39 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.682 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.48 ' O ' HG12 ' A' ' 37' ' ' ILE . 13.4 m -87.98 117.24 26.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.692 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.1 mm? -63.69 -41.04 98.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.307 -172.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.63 -25.89 65.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.449 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 89.7 m -78.97 -43.98 23.36 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.86 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 1.083 HD12 ' HA ' ' A' ' 31' ' ' ASN . 47.2 mm -58.61 -31.05 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.527 ' HG3' HD13 ' A' ' 70' ' ' LEU . 28.3 tt0 -57.33 -47.77 80.71 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.563 174.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.571 ' HD2' HD12 ' A' ' 42' ' ' ILE . 14.0 mmmm -76.5 -35.2 58.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.921 -178.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' HB3' HD12 ' A' ' 25' ' ' LEU . 23.8 mm-40 -62.18 -40.72 96.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.305 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.407 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 19.4 mt -58.9 -33.16 70.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.742 HG12 ' H ' ' A' ' 62' ' ' THR . 76.9 mt -74.64 -46.89 40.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.671 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.9 t -61.89 -47.54 84.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.361 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.556 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 32.1 t80 -68.31 -27.88 66.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.364 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 20.3 t -61.08 -28.97 69.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.004 0.43 . . . . 0.0 110.603 174.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -85.98 -42.04 14.35 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -78.17 49.07 0.79 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.03 0.443 . . . . 0.0 111.512 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.775 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -144.34 -173.54 4.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.971 178.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.69 175.85 5.51 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 121.211 -0.196 . . . . 0.0 110.626 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.66 -53.55 12.9 Favored Glycine 0 CA--C 1.522 0.477 0 N-CA-C 114.966 0.747 . . . . 0.0 114.966 -170.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -67.02 -29.56 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 117.62 0.71 . . . . 0.0 110.687 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.775 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 71.6 mt-10 -80.63 -36.25 32.88 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.513 -176.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -61.08 -53.33 58.41 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 173.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.44 ' O ' ' HD3' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -57.91 -34.64 70.05 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.842 178.061 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.772 HD23 HG12 ' A' ' 13' ' ' VAL . 42.7 tp -60.93 -32.69 72.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.43 -175.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.401 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 10.3 p -66.94 -21.09 65.99 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.612 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -71.02 -22.96 62.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.127 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.588 ' HB3' HG12 ' A' ' 97' ' ' ILE . 97.3 m-85 -80.47 -35.21 35.16 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.45 -5.53 58.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.844 -179.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 95.17 17.96 35.45 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.992 170.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.401 ' HB1' ' HB2' ' A' ' 56' ' ' CYS . . . -89.31 -179.29 5.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.227 0.513 . . . . 0.0 111.414 -177.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.742 ' H ' HG12 ' A' ' 42' ' ' ILE . 63.2 p 59.6 15.83 4.91 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.531 1.132 . . . . 0.0 113.288 177.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 61.23 -178.94 0.11 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 122.604 0.362 . . . . 0.0 110.903 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.7 t70 71.74 -47.82 0.67 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.435 0.694 . . . . 0.0 110.974 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.27 155.92 27.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.78 112.85 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.889 0.376 . . . . 0.0 111.186 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.0 p -64.9 -14.13 58.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.532 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -49.36 -50.92 37.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.486 HD11 ' O ' ' A' ' 58' ' ' TYR . 18.6 tt -80.67 -24.39 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.699 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.527 HD13 ' HG3' ' A' ' 38' ' ' GLU . 3.4 tm? -57.04 -48.47 78.45 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.584 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 7.8 p -69.56 -35.16 75.14 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.853 177.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.46 -32.62 71.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.784 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.427 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 96.9 t -85.85 -47.08 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.503 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.528 ' HG1' ' HA ' ' A' ' 71' ' ' SER . 7.4 p -55.44 -46.76 76.7 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 34' ' ' LEU . 3.5 mpt_? -56.38 -56.72 28.75 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.949 -177.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.556 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 72.4 Cg_endo -75.26 -13.77 20.79 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 121.465 1.444 . . . . 0.0 113.836 -177.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.2 mmt -74.9 -33.22 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.067 0.46 . . . . 0.0 109.794 172.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.1 m -68.88 -14.5 63.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.561 -173.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.714 HG12 ' HG3' ' A' ' 81' ' ' MET . 6.5 p -139.53 149.53 22.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.579 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 2.0 t60 -58.04 105.32 0.26 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -177.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.714 ' HG3' HG12 ' A' ' 79' ' ' VAL . 45.7 mtp -141.07 174.24 4.09 Favored Pre-proline 0 CA--C 1.541 0.606 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -169.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.666 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 1.9 Cg_endo -40.83 2.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.114 1 C-N-CA 128.301 6.001 . . . . 0.0 118.97 177.305 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . 0.607 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -35.74 -44.0 0.32 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -159.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.619 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -59.66 -37.62 79.23 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.033 0.833 . . . . 0.0 110.931 177.331 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 38.0 ttpt -84.81 -17.78 37.03 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.978 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.607 HD13 ' HA ' ' A' ' 83' ' ' ALA . 44.9 mt -61.8 -41.66 91.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.407 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' CYS . . . . . 0.787 ' HB2' HD11 ' A' ' 18' ' ' LEU . 46.6 t -64.65 -27.43 68.92 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.66 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 33.7 tt0 -70.06 -31.34 68.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.381 0.61 . . . . 0.0 109.57 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 53.7 mtmt -78.84 -28.61 44.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.92 174.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 88.0 mt -68.4 -23.85 64.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.298 176.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 50.6 mtpt -62.1 -25.04 67.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -75.25 -34.25 61.37 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.31 -52.14 36.94 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.746 ' HB3' HG13 ' A' ' 97' ' ' ILE . 29.2 t0 -160.7 124.61 3.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.263 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.6 m -74.24 -17.96 60.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.083 -176.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -76.13 -14.04 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.081 0.467 . . . . 0.0 110.446 -179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.746 HG13 ' HB3' ' A' ' 94' ' ' ASP . 65.6 mt -67.12 -22.76 29.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.502 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' CYS . . . . . 0.461 ' HB2' ' HB2' ' A' ' 11' ' ' CYS . 14.2 p -117.52 -38.42 3.31 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.492 -176.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -85.11 56.87 4.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.544 ' HB2' HG23 ' A' ' 13' ' ' VAL . 6.1 mp -85.21 -49.37 8.27 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 174.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.7 mmtt 68.55 130.61 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 O-C-N 124.035 0.834 . . . . 0.0 112.079 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.167 -177.983 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 . . . . . 0 N--CA 1.482 1.147 0 CA-C-O 120.509 0.195 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 65.3 -169.87 0.2 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.347 169.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.42 147.22 14.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.809 -1.087 . . . . 0.0 108.598 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.48 109.4 2.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.578 -175.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 108.88 -8.48 33.88 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.199 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.401 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 26.0 mmt85 53.41 66.01 5.09 Favored Pre-proline 0 N--CA 1.466 0.335 0 CA-C-O 120.913 0.387 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 25.3 Cg_endo -93.8 55.46 0.36 Allowed 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 123.34 2.693 . . . . 0.0 110.807 178.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.972 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -70.09 -50.83 26.2 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.544 -172.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.884 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -174.1 -91.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -169.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -134.75 -80.7 0.44 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB3' ' H ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -71.14 -88.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.38 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 36.9 tt0 -163.64 -77.83 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.553 0 O-C-N 122.315 -0.24 . . . . 0.0 110.563 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.794 HG13 HD22 ' A' ' 55' ' ' LEU . 46.6 t -56.95 -40.36 71.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.666 ' HA ' HD23 ' A' ' 55' ' ' LEU . 35.8 t -59.78 -40.68 89.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.085 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.701 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 15.2 ptpt -75.97 -42.54 48.09 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.624 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 4.7 mm-40 -65.74 -40.9 92.6 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.006 -176.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -62.15 -54.82 35.72 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.62 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 95.5 mt -57.84 -52.74 64.21 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 122.957 0.161 . . . . 0.0 110.772 -177.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.972 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -60.14 -51.3 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 123.125 0.266 . . . . 0.0 111.391 -176.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 20' ' ' ARG . 23.4 mtm180 -67.58 -39.37 84.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.218 -175.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -64.2 -41.76 96.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 122.086 0.946 . . . . 0.0 109.667 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.709 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 14.5 t80 -64.81 -55.7 18.04 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.722 -173.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -76.16 -19.33 58.56 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.998 -176.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 t -64.59 -55.19 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.013 174.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.616 ' HA ' HG12 ' A' ' 30' ' ' VAL . 3.4 mp -59.74 -40.32 87.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.508 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 22' ' ' TYR . 51.4 mm -64.27 -43.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -74.82 -43.74 53.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.461 -177.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.776 ' HB2' HG13 ' A' ' 30' ' ' VAL . 16.2 mtm180 -67.79 -14.38 62.91 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.007 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.19 28.4 66.33 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.776 HG13 ' HB2' ' A' ' 28' ' ' ARG . 3.4 p -111.93 51.81 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 CA-C-O 122.761 1.267 . . . . 0.0 109.27 -175.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.473 ' CG ' ' H ' ' A' ' 32' ' ' PHE . 9.2 t-20 -145.09 -167.32 2.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.318 -177.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.473 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 95.8 m-85 68.67 4.59 4.45 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.575 0.75 . . . . 0.0 111.139 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.515 ' O ' HG13 ' A' ' 37' ' ' ILE . 15.5 m -128.47 107.35 9.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.255 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.064 -173.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -68.72 -32.75 72.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.238 0.542 . . . . 0.0 110.492 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.468 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 55.3 m -73.11 -42.16 63.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 33' ' ' SER . 53.7 mt -59.27 -32.97 49.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.25 0.547 . . . . 0.0 109.543 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -68.43 -44.16 75.56 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.526 ' HA ' HD13 ' A' ' 42' ' ' ILE . 47.5 tptt -69.91 -39.06 76.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.682 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.82 -28.31 62.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.904 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.39 -46.87 82.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 168.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.526 HD13 ' HA ' ' A' ' 39' ' ' LYS . 82.5 mt -56.06 -52.11 54.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 176.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.5 m -57.14 -55.66 31.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.714 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.88 -39.4 83.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.084 -173.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 56.9 m -62.93 -39.35 94.32 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.35 -29.4 24.51 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.494 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -92.23 58.71 3.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.709 0.766 . . . . 0.0 110.582 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.98 -164.94 1.98 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.295 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -98.11 167.33 10.95 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.398 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.99 -40.14 19.7 Favored Glycine 0 C--N 1.333 0.382 0 O-C-N 123.839 0.712 . . . . 0.0 114.298 -170.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.573 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 5.0 mptp? -51.86 -48.48 63.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.919 0.39 . . . . 0.0 111.221 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -82.99 -35.44 25.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.198 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 2.9 m120 -62.59 -33.95 76.0 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 23.5 tpt180 -83.42 -38.96 21.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.851 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.794 HD22 HG13 ' A' ' 13' ' ' VAL . 19.7 tp -55.34 -39.53 70.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.316 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.76 -23.05 65.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.557 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 45.6 m-85 -61.78 -27.15 68.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.614 176.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.446 ' HB3' HG12 ' A' ' 97' ' ' ILE . 62.0 m-85 -86.33 -19.96 29.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.85 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.7 mt -102.2 -22.5 14.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.365 -174.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 124.73 -128.56 6.76 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.205 -0.522 . . . . 0.0 111.822 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.714 ' H ' ' HG ' ' A' ' 70' ' ' LEU . . . 57.24 -167.72 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 112.201 175.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 58.3 p 56.68 11.04 0.8 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.085 0.954 . . . . 0.0 112.922 177.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt 60.8 13.98 4.81 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.879 0.472 . . . . 0.0 111.467 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.409 ' HB3' ' H ' ' A' ' 65' ' ' ALA . 3.4 m-20 -151.28 -161.65 1.38 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.088 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.409 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . 70.94 -84.03 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 O-C-N 123.817 0.698 . . . . 0.0 111.38 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.02 104.48 5.25 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.92 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.5 p -83.84 -26.31 29.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -77.09 -47.28 20.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.029 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.1 tt -64.7 -21.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.714 ' HG ' ' H ' ' A' ' 61' ' ' ALA . 2.7 tt -55.06 -44.84 75.15 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.075 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.596 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 81.8 p -65.4 -29.57 70.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -74.19 -14.04 60.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.039 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 52.9 t -88.25 -55.88 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.186 0.517 . . . . 0.0 110.615 171.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.4 p -58.25 -42.51 86.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.579 -173.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.596 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.1 mpt_? -59.14 -55.1 49.81 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.504 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 50.4 Cg_endo -72.18 -14.41 28.68 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.52 1.48 . . . . 0.0 113.17 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -14.09 59.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.806 0.336 . . . . 0.0 110.51 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.432 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 43.6 t -80.9 -13.67 58.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.774 -177.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.718 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.2 p -146.36 149.53 15.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -175.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.709 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 5.7 t60 -60.38 107.78 0.71 Allowed 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.718 ' HG3' HG13 ' A' ' 79' ' ' VAL . 34.6 mtp -140.68 170.36 9.7 Favored Pre-proline 0 CA--C 1.533 0.317 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -167.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.521 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 23.8 Cg_exo -41.25 2.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.865 1 C-N-CA 128.149 5.899 . . . . 0.0 119.125 174.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.617 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -38.5 -24.37 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 -166.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.884 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -65.2 -57.44 8.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.819 0.819 . . . . 0.0 109.477 170.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.7 ttpt -70.27 -14.45 62.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.732 179.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.617 HD11 ' HA ' ' A' ' 83' ' ' ALA . 38.2 mt -66.12 -27.09 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 122.06 -0.4 . . . . 0.0 110.539 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.603 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 50.8 t -75.61 -22.87 56.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.611 0.72 . . . . 0.0 109.65 175.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.8 mt-10 -75.64 -38.41 58.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.168 173.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -62.65 -35.99 81.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.647 171.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.529 HD22 HD13 ' A' ' 93' ' ' LEU . 21.4 mt -61.81 -28.68 69.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.313 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.558 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.7 mmmm -65.85 -24.06 66.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.602 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -81.69 -14.63 56.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.924 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.529 HD13 HD22 ' A' ' 90' ' ' LEU . 96.3 mt -94.37 -39.83 10.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.163 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -162.38 137.47 7.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.974 175.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 41.7 t -85.07 -21.92 29.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.163 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -68.59 -19.71 64.47 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.829 0.347 . . . . 0.0 110.844 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.446 HG12 ' HB3' ' A' ' 58' ' ' TYR . 51.7 mt -61.0 -30.17 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.305 0.574 . . . . 0.0 110.283 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.558 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 44.3 t -85.96 79.72 9.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.167 176.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.514 ' HB3' ' H ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER 179.37 -139.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.896 174.015 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.548 ' O ' HG23 ' A' ' 13' ' ' VAL . 6.7 mp 63.63 21.98 12.95 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.739 0.649 . . . . 0.0 111.131 177.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.422 ' HG2' ' OE1' ' A' ' 99' ' ' GLU . 33.4 mmtp -46.15 134.53 8.39 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 123.729 0.643 . . . . 0.0 112.078 -170.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.573 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.0 m-85 -54.19 -59.29 4.85 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 123.388 0.43 . . . . 0.0 110.934 -174.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -136.67 91.7 2.68 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.573 ' H ' ' HD3' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -77.3 -29.32 53.67 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 160.565 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-N 113.989 -1.46 . . . . 0.0 111.33 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 16.6 mm-40 . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' A' ' 1' ' ' GLN . 5.2 pt-20 62.19 157.38 0.05 Allowed 'General case' 0 N--CA 1.474 0.745 0 O-C-N 124.732 1.27 . . . . 0.0 113.238 174.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.643 ' HB3' ' HG2' ' A' ' 23' ' ' LYS . . . -109.27 143.16 39.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.159 173.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.03 111.0 2.74 Favored Glycine 0 N--CA 1.452 -0.25 0 O-C-N 123.662 0.601 . . . . 0.0 113.185 -174.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 117.32 -16.58 12.8 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.453 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.575 ' HD2' ' OE1' ' A' ' 16' ' ' GLU . 13.2 mmt180 54.72 55.32 11.2 Favored Pre-proline 0 N--CA 1.467 0.408 0 C-N-CA 122.529 0.331 . . . . 0.0 111.804 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.534 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 22.1 Cg_endo -97.04 71.05 0.11 Allowed 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.397 2.731 . . . . 0.0 112.223 -177.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.633 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -85.78 -37.46 9.41 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.818 -1.182 . . . . 0.0 112.271 -177.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 15' ' ' LYS . . . 175.33 -109.54 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.19 0.596 . . . . 0.0 109.879 -174.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -149.85 -35.22 0.17 Allowed 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 172.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.505 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 91.8 m -67.67 101.98 1.12 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.982 0.42 . . . . 0.0 109.943 173.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.67 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 39.3 tt0 -46.3 -59.9 2.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.645 -1.161 . . . . 0.0 113.895 -165.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.949 HG11 HD23 ' A' ' 55' ' ' LEU . 23.1 t -64.11 -47.97 87.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.356 0.598 . . . . 0.0 110.839 -176.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.779 ' HB2' HG23 ' A' ' 97' ' ' ILE . 5.1 t -59.22 -47.07 86.69 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.649 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 10.3 ptmm? -64.81 -38.29 90.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.308 -176.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 15.8 mm-40 -65.02 -42.9 93.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.605 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -62.61 -51.41 67.41 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.624 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 58.2 mt -62.39 -54.81 34.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.738 -176.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.633 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 28.5 t-20 -58.18 -45.61 87.22 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.271 0.357 . . . . 0.0 111.843 -174.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HG2' ' HA ' ' A' ' 2' ' ' GLU . 87.0 mtm180 -64.11 -50.18 69.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.838 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -55.64 -47.65 76.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.328 1.061 . . . . 0.0 110.185 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.726 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 3.2 t80 -56.89 -52.14 66.32 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.807 -1.997 . . . . 0.0 112.412 -171.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.643 ' HG2' ' HB3' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -83.46 -23.83 32.06 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.966 -177.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.638 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 42.6 m -57.02 -44.14 82.56 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.645 176.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.666 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 4.2 mp -63.91 -28.23 69.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.534 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 50.4 mm -71.63 -46.51 62.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 176.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.17 -46.9 81.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.859 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 1.056 ' HG3' HG23 ' A' ' 30' ' ' VAL . 20.5 ptp180 -85.31 -13.76 48.64 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.93 49.95 5.41 Favored Glycine 0 C--O 1.228 -0.239 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.439 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 1.056 HG23 ' HG3' ' A' ' 28' ' ' ARG . 59.0 t -118.71 3.46 7.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.688 1.232 . . . . 0.0 110.338 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.442 HD21 ' HA ' ' A' ' 31' ' ' ASN . 1.0 OUTLIER -96.92 174.49 6.76 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.303 -170.508 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 68.38 9.51 7.3 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.875 0.734 . . . . 0.0 112.018 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.471 ' O ' HG13 ' A' ' 37' ' ' ILE . 41.6 m -136.99 110.15 7.78 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.47 -35.14 75.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.313 -172.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.2 -36.24 74.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.375 0.607 . . . . 0.0 110.361 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.929 HG22 HG11 ' A' ' 30' ' ' VAL . 19.1 m -74.16 -39.87 62.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.494 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.487 HG21 HG22 ' A' ' 74' ' ' THR . 78.7 mt -61.37 -34.36 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.36 173.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.91 -50.33 69.15 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.909 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.407 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 25.1 mmmt -62.28 -42.15 99.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.708 -176.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' HG3' HG13 ' A' ' 30' ' ' VAL . 26.9 mm-40 -80.68 -16.78 53.09 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.503 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.591 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.3 tp -68.87 -41.23 78.67 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 172.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.558 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 1.7 mp -66.42 -41.44 88.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.46 173.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.401 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 32.2 t -64.03 -56.1 17.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.596 ' HA ' ' HB3' ' A' ' 47' ' ' ASP . 22.2 t80 -62.73 -28.78 70.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.223 0.535 . . . . 0.0 109.982 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.558 ' HB3' ' O ' ' A' ' 42' ' ' ILE . 53.8 t -49.2 -52.28 27.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.628 174.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.6 mt -89.55 -18.37 26.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.776 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.596 ' HB3' ' HA ' ' A' ' 44' ' ' PHE . 27.6 t70 -63.83 -29.16 70.38 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 111.173 -177.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.669 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -73.5 -169.63 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.945 177.132 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -100.37 173.44 6.59 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.365 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -45.56 -41.63 9.51 Favored Glycine 0 C--N 1.332 0.359 0 O-C-N 123.961 0.788 . . . . 0.0 114.453 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -59.45 -53.63 55.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.889 0.345 . . . . 0.0 111.177 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.669 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 2.1 mp0 -75.72 -27.66 58.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.467 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -61.42 -40.46 94.49 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -69.93 -43.42 71.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.197 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.949 HD23 HG11 ' A' ' 13' ' ' VAL . 23.9 tp -55.77 -35.81 66.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.941 178.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.97 -28.14 69.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.084 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -63.88 -31.94 73.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.153 0.501 . . . . 0.0 109.945 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -83.55 -23.21 32.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.357 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.95 -7.69 56.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.987 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.443 ' HA3' ' CG2' ' A' ' 69' ' ' ILE . . . 72.53 43.69 43.61 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.239 -0.891 . . . . 0.0 113.735 171.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.591 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -127.98 23.07 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.02 -117.76 0.31 Allowed 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.092 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -129.05 142.73 50.81 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 -178.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 60.88 31.42 20.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.723 0.773 . . . . 0.0 109.842 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.439 ' HB1' ' HA2' ' A' ' 60' ' ' GLY . . . -104.23 -178.54 3.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.621 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.446 ' HB3' HG21 ' A' ' 69' ' ' ILE . . . -69.39 119.85 14.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.4 p -70.32 -28.02 64.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -72.0 -45.73 59.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.125 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.757 HD13 HD12 ' A' ' 90' ' ' LEU . 14.6 tt -66.03 -28.76 44.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.443 -175.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.448 HD12 HD21 ' A' ' 41' ' ' LEU . 46.5 tp -57.13 -45.53 83.44 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.373 0.606 . . . . 0.0 110.419 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.666 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 17.0 m -71.87 -37.48 70.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.246 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -64.33 -22.9 67.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.967 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 69' ' ' ILE . 94.3 t -86.19 -47.74 16.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.864 174.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.487 HG22 HG21 ' A' ' 37' ' ' ILE . 11.6 p -58.27 -33.64 69.62 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.666 ' HD2' ' O ' ' A' ' 71' ' ' SER . 5.5 mtt180 -67.29 -55.39 15.55 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.616 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 29.2 Cg_endo -67.34 -16.79 48.86 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.261 1.308 . . . . 0.0 113.01 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.6 mmt -78.2 -14.41 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.641 0.257 . . . . 0.0 111.002 175.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -79.89 -14.73 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.658 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.7 p -150.06 150.09 13.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -176.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.726 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 7.5 t60 -60.9 110.72 1.41 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.182 0.515 . . . . 0.0 110.122 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.658 ' HG3' HG13 ' A' ' 79' ' ' VAL . 48.2 mtp -137.6 173.73 5.11 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.345 -167.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.546 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 2.6 Cg_endo -40.64 0.9 0.0 OUTLIER 'Trans proline' 0 C--O 1.206 -1.081 1 C-N-CA 127.853 5.702 . . . . 0.0 118.863 175.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.528 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.41 -32.31 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.809 1.781 . . . . 0.0 115.809 -161.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.564 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 1.5 mtm -54.24 -48.05 71.54 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.965 0.888 . . . . 0.0 109.971 171.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 82' ' ' PRO . 3.1 mptp? -70.34 -29.95 66.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.677 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.528 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 50.2 mt -64.71 -29.73 48.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.052 0.453 . . . . 0.0 110.184 -174.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 52.6 t -61.28 -39.75 91.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.307 0.575 . . . . 0.0 109.993 172.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 15.8 mm-40 -72.05 -22.28 61.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.742 176.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -72.18 -38.87 69.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.757 HD12 HD13 ' A' ' 69' ' ' ILE . 2.8 mm? -66.76 -27.24 67.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.629 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.569 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.0 mmmm -63.51 -23.26 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.866 176.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -77.5 -17.45 57.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.778 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 mp -95.31 -40.87 9.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.608 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -164.32 135.31 4.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.796 0.332 . . . . 0.0 110.695 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.7 m -86.26 -15.48 40.61 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -67.63 -21.67 65.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.246 0.546 . . . . 0.0 110.341 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.779 HG23 ' HB2' ' A' ' 14' ' ' CYS . 57.3 mt -61.87 -23.58 31.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.33 176.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.569 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 24.2 t -89.43 -48.29 7.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.991 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -102.95 21.81 15.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.913 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.95 -42.91 99.65 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 101' ' ' LYS . 60.7 mmtt 63.79 163.3 0.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.55 -1.205 . . . . 0.0 113.883 174.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.412 ' HB3' ' H ' ' A' ' 103' ' ' GLU . 76.3 m-85 -107.79 -154.95 0.54 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.789 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.412 ' H ' ' HB3' ' A' ' 102' ' ' TYR . 4.3 mp0 -63.09 -82.02 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.21 177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.545 ' HG2' ' H ' ' A' ' 105' ' ' THR . 14.7 ttmm 54.47 -150.79 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.248 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.545 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 7.4 t . . . . . 0 C--O 1.25 1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 112.84 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 120.472 0.177 . . . . 0.0 110.588 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 66.0 -91.42 0.03 OUTLIER 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.496 0.718 . . . . 0.0 111.416 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.06 -176.76 4.98 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.086 0.469 . . . . 0.0 111.597 -176.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 100.98 35.69 4.17 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -174.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.27 20.43 57.07 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.034 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.486 ' O ' ' HD2' ' A' ' 15' ' ' LYS . 18.0 mmm180 51.55 71.1 1.61 Allowed Pre-proline 0 N--CA 1.467 0.386 0 C-N-CA 122.74 0.416 . . . . 0.0 110.822 -176.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -90.28 69.85 1.61 Allowed 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 123.379 2.719 . . . . 0.0 111.207 -175.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.915 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -84.39 -26.18 40.61 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.808 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.628 ' HB3' ' HB3' ' A' ' 87' ' ' CYS . . . -172.31 -83.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.119 0.485 . . . . 0.0 111.039 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t70 176.02 -27.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.594 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 5.4 m -73.09 -147.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.095 169.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.449 ' HA ' ' HE2' ' A' ' 15' ' ' LYS . 35.5 tt0 -130.34 -73.84 0.55 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.117 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.915 HG13 HD21 ' A' ' 55' ' ' LEU . 93.8 t -60.48 -47.92 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.498 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.664 ' HA ' HD22 ' A' ' 55' ' ' LEU . 41.9 t -58.56 -37.69 76.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.185 0.517 . . . . 0.0 110.154 174.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.705 ' HG3' ' CA ' ' A' ' 8' ' ' GLY . 27.7 ttpt -64.65 -55.55 19.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.847 -179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.473 ' HB2' ' HH ' ' A' ' 102' ' ' TYR . 61.9 mm-40 -58.94 -44.89 91.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.898 -177.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -58.02 -56.66 19.18 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.237 0.335 . . . . 0.0 111.717 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' ' 87' ' ' CYS . 97.9 mt -60.1 -48.32 82.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.722 0.296 . . . . 0.0 111.022 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.915 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.0 t-20 -67.06 -41.72 85.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.355 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -78.05 -34.26 50.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.925 -175.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.46 -47.04 87.52 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.825 0.821 . . . . 0.0 109.246 172.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.72 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.6 t80 -56.59 -49.88 73.6 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 113.604 -1.635 . . . . 0.0 111.22 -177.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.503 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -71.57 -31.7 67.26 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.319 -179.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.503 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 73.1 m -60.16 -38.33 82.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.383 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.65 ' HG ' ' CG2' ' A' ' 30' ' ' VAL . 4.3 mp -73.73 -22.46 59.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.011 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 46.9 mm -80.35 -43.81 21.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.03 -55.18 35.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.806 174.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.406 ' HB2' HG11 ' A' ' 30' ' ' VAL . 53.9 mtm-85 -78.93 -14.72 59.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.892 -175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.24 31.66 74.91 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.765 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.65 ' CG2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 m -99.01 3.38 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 122.044 0.926 . . . . 0.0 110.47 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.609 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.6 t-20 -83.62 174.15 10.78 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.093 -169.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.2 t80 75.39 -11.03 1.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.006 0.923 . . . . 0.0 110.795 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 37' ' ' ILE . 24.2 m -100.47 105.41 16.86 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.615 HD21 ' HE ' ' A' ' 75' ' ' ARG . 12.3 tp -62.78 -38.04 89.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.812 -171.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -63.0 -42.04 99.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.401 0.619 . . . . 0.0 110.215 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.7 m -67.27 -38.86 85.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.275 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.541 HG13 ' O ' ' A' ' 33' ' ' SER . 73.9 mt -58.18 -34.17 48.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.724 0.297 . . . . 0.0 110.284 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -69.1 -45.26 70.67 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.463 177.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -62.94 -40.0 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.195 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.5 ' HG3' HG21 ' A' ' 30' ' ' VAL . 10.0 mm-40 -68.65 -39.39 80.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.309 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.596 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 17.9 mt -55.62 -55.64 29.66 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 120.767 0.318 . . . . 0.0 110.144 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.566 HD11 HD11 ' A' ' 70' ' ' LEU . 1.7 mp -57.47 -46.13 85.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.997 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -61.34 -51.09 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.491 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -61.88 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.068 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.8 m -65.4 -28.59 69.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.521 -178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -86.62 -49.26 7.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -82.32 63.8 6.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.424 0.631 . . . . 0.0 111.067 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -150.92 -161.45 1.34 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.693 178.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 pttm -103.18 166.86 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 121.081 -0.248 . . . . 0.0 111.241 178.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.36 -43.48 26.96 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 124.068 0.855 . . . . 0.0 114.398 -170.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.808 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.0 mptt -58.37 -47.69 83.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.234 0.517 . . . . 0.0 111.249 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -71.82 -41.08 68.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.507 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -58.09 -44.18 87.49 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -70.01 -41.86 73.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.871 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.915 HD21 HG13 ' A' ' 13' ' ' VAL . 23.5 tp -53.62 -42.78 68.09 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.691 -177.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.402 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 86.2 m -67.34 -14.13 62.64 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -72.31 -25.73 61.68 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.492 ' HB3' HG12 ' A' ' 97' ' ' ILE . 77.0 m-85 -84.99 -40.25 17.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.75 175.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.417 HD22 HD11 ' A' ' 97' ' ' ILE . 82.5 mt -74.08 -18.8 60.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.39 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.05 -13.5 63.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.293 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.596 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -85.59 75.44 10.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.21 0.529 . . . . 0.0 111.582 -176.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.595 HG22 ' H ' ' A' ' 63' ' ' LYS . 5.8 m -152.78 176.77 11.43 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.595 ' H ' HG22 ' A' ' 62' ' ' THR . 29.4 mtpp -63.17 -37.69 88.21 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.63 -152.69 0.32 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.201 -0.908 . . . . 0.0 109.21 174.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.52 -164.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 112.201 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.75 126.8 34.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.567 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.4 p -86.18 -21.16 27.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.993 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -81.28 -44.92 17.01 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.361 -175.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.479 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 13.9 tt -63.33 -24.61 36.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.428 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.566 HD11 HD11 ' A' ' 42' ' ' ILE . 3.3 tt -60.14 -44.25 95.09 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 174.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.634 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 19.0 m -66.51 -18.87 65.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.01 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.551 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 27.8 mm-40 -71.62 -56.08 6.53 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.28 -45.25 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.41 0.444 . . . . 0.0 111.921 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.4 p -55.24 -34.28 63.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.634 ' HD3' ' O ' ' A' ' 71' ' ' SER . 3.1 mpt_? -66.5 -56.45 15.32 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.86 -173.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.718 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 25.8 Cg_endo -65.61 -30.13 51.58 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.624 1.549 . . . . 0.0 112.977 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.2 mmt -67.79 -14.13 62.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.16 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -78.35 -15.27 58.88 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.451 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.552 HG22 ' HG3' ' A' ' 81' ' ' MET . 4.0 m -144.23 -169.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.933 0.397 . . . . 0.0 111.386 -174.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.72 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 58.1 t60 -89.57 99.44 12.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.718 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 38.9 mtp -136.34 169.67 12.89 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -170.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.564 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.1 Cg_endo -42.44 -0.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.935 1 C-N-CA 127.809 5.672 . . . . 0.0 118.128 177.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.647 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -36.82 -35.07 0.08 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -159.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.63 ' HG2' ' H ' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.72 -51.65 57.58 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 118.664 0.665 . . . . 0.0 110.513 177.014 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.63 ' H ' ' HG2' ' A' ' 84' ' ' MET . 42.7 mtmt -67.21 -19.49 65.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.711 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.647 HD11 ' HA ' ' A' ' 83' ' ' ALA . 27.9 mt -63.86 -28.97 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.912 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.628 ' HB3' ' HB3' ' A' ' 9' ' ' ALA . 49.3 t -68.84 -35.07 76.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.717 176.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.839 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 67.7 mm-40 -68.21 -28.54 67.34 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.792 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.486 ' CD ' ' HA ' ' A' ' 86' ' ' ILE . 31.7 mttm -74.72 -40.14 61.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.24 177.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 92.3 mt -68.35 -25.21 64.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.183 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.839 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 58.2 mtpt -61.24 -21.24 63.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.526 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -76.18 -22.16 55.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.099 0.476 . . . . 0.0 110.386 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.2 -53.23 4.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.425 ' OD1' ' HB2' ' A' ' 96' ' ' GLN . 10.8 t70 -138.18 115.01 10.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.423 177.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.1 m -82.62 -15.01 53.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.792 0.33 . . . . 0.0 111.336 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.425 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 2.1 mp0 -65.74 -34.86 79.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.919 -177.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.492 HG12 ' HB3' ' A' ' 58' ' ' TYR . 78.3 mt -48.04 -42.0 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.47 176.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.596 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 35.9 t -72.68 -42.27 64.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.885 -173.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -81.31 14.5 2.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.67 116.03 21.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 170.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.435 ' HD3' ' HB3' ' A' ' 12' ' ' GLU . 32.4 mmtp -116.58 149.65 39.31 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.808 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 98.9 m-85 -71.89 -171.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.703 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 10.9 mm-40 -56.92 -54.57 45.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 171.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 159.68 -14.06 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 O-C-N 124.785 1.303 . . . . 0.0 110.07 168.418 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.253 1.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.103 177.831 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.989 ' HB2' ' HB3' ' A' ' 23' ' ' LYS . 5.8 mm100 . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.408 ' OE2' ' HD2' ' A' ' 6' ' ' ARG . 8.0 tp10 51.25 86.05 0.04 OUTLIER 'General case' 0 C--N 1.342 0.266 0 CA-C-O 121.276 0.56 . . . . 0.0 110.11 -169.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.523 ' HB2' ' HG3' ' A' ' 7' ' ' PRO . . . -76.11 9.18 2.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.354 -174.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 102.86 -46.06 1.27 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.936 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -90.91 17.61 54.46 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.725 -178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.408 ' HD2' ' OE2' ' A' ' 2' ' ' GLU . 12.4 mmm180 55.49 75.36 0.6 Allowed Pre-proline 0 N--CA 1.466 0.349 0 C-N-CA 123.023 0.529 . . . . 0.0 110.899 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.523 ' HG3' ' HB2' ' A' ' 3' ' ' ALA . 70.4 Cg_endo -96.93 61.0 0.11 Allowed 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 123.029 2.486 . . . . 0.0 111.605 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.654 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -96.71 -19.73 26.3 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.439 -176.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.773 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . 173.21 -153.08 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.208 0.603 . . . . 0.0 109.725 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -121.39 -36.67 3.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.641 0.258 . . . . 0.0 110.354 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.569 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 42.3 m -56.36 -81.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.869 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.822 ' HA ' ' HE3' ' A' ' 15' ' ' LYS . 7.3 tp10 170.41 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.727 0.299 . . . . 0.0 111.627 172.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.655 HG13 HD22 ' A' ' 55' ' ' LEU . 53.5 t -64.59 -38.16 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.477 -172.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.512 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 21.7 p -60.24 -30.71 69.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 174.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.822 ' HE3' ' HA ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -72.18 -41.65 66.75 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.219 -175.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.453 ' HB3' HH11 ' A' ' 20' ' ' ARG . 43.6 mm-40 -56.23 -48.47 76.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.667 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -61.55 -54.98 35.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.144 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 96.0 mt -59.57 -48.16 82.76 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.488 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.7 t-20 -68.5 -44.75 74.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.453 HH11 ' HB3' ' A' ' 16' ' ' GLU . 30.7 mtp180 -64.63 -39.19 93.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.687 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.533 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 76.2 t80 -62.69 -50.24 71.92 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.954 0.883 . . . . 0.0 109.684 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.753 ' HD1' ' HG3' ' A' ' 1' ' ' GLN . 29.9 t80 -47.37 -55.06 9.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.84 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.989 ' HB3' ' HB2' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -68.74 -37.74 79.64 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.204 -179.303 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.62 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 27.2 t -59.23 -33.18 70.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.388 0.613 . . . . 0.0 110.758 -175.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.571 ' HA ' HG11 ' A' ' 30' ' ' VAL . 2.9 mp -83.04 -46.69 12.54 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.573 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 22' ' ' TYR . 28.8 mm -67.34 -37.78 79.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.176 0.513 . . . . 0.0 110.225 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -72.28 -46.07 57.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.407 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.946 ' HG2' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -82.08 -14.15 56.24 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.031 0.443 . . . . 0.0 110.75 -177.028 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.58 1.78 60.28 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.061 172.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.946 HG12 ' HG2' ' A' ' 28' ' ' ARG . 1.9 p -87.94 99.02 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.546 ' OD1' ' HA ' ' A' ' 78' ' ' SER . 7.5 t-20 -165.73 -176.96 4.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.969 -0.457 . . . . 0.0 111.253 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 62.5 38.57 12.51 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.35 0.66 . . . . 0.0 111.54 -177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.589 ' O ' HG12 ' A' ' 37' ' ' ILE . 55.5 m -157.8 104.94 1.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.913 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.95 -43.68 91.29 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -172.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.46 -38.25 83.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.25 0.548 . . . . 0.0 110.715 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.1 m -73.6 -40.82 63.55 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.333 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' ' 33' ' ' SER . 35.9 mm -58.58 -37.61 65.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -69.46 -44.26 71.58 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 32.3 mmtm -77.0 -18.8 57.96 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.925 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.484 ' HG3' HG21 ' A' ' 30' ' ' VAL . 62.1 mm-40 -85.35 -28.02 25.48 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.933 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.609 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 13.2 mt -59.71 -55.46 34.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 168.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.415 HD11 ' HD3' ' A' ' 39' ' ' LYS . 60.4 mt -53.63 -43.85 55.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.069 176.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -63.85 -48.1 78.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.905 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -68.55 -32.92 73.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.854 0.359 . . . . 0.0 110.595 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 91.3 m -66.07 -22.62 66.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.946 0.403 . . . . 0.0 110.872 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.8 tp -87.64 -41.57 13.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.104 172.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -79.17 48.35 0.86 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.712 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -142.05 -172.65 3.62 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.521 177.773 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -97.56 173.46 7.14 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.58 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.51 -43.25 58.59 Favored Glycine 0 C--N 1.33 0.224 0 O-C-N 123.548 0.53 . . . . 0.0 114.022 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.443 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.7 tppt? -61.14 -42.25 98.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.135 0.493 . . . . 0.0 110.153 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.712 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 20.6 mt-10 -78.27 -37.56 44.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.766 -176.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -57.54 -40.57 79.12 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -78.96 -36.38 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.633 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.655 HD22 HG13 ' A' ' 13' ' ' VAL . 38.3 tp -53.63 -34.62 59.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.569 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.615 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 9.2 t -68.12 -15.35 63.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.403 ' CZ ' HG22 ' A' ' 62' ' ' THR . 77.4 m-85 -74.56 -21.09 59.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.292 0.568 . . . . 0.0 109.964 176.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.488 ' HB3' HG12 ' A' ' 97' ' ' ILE . 98.7 m-85 -86.12 -34.56 20.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.008 174.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.78 -36.11 67.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.503 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.56 -3.76 34.6 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 121.057 -0.592 . . . . 0.0 113.862 172.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.615 ' HB1' ' SG ' ' A' ' 56' ' ' CYS . . . -92.44 53.22 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -173.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.427 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -126.07 -84.94 0.62 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.058 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.427 ' H ' ' HB ' ' A' ' 62' ' ' THR . 27.5 mtpp -146.09 -70.21 0.26 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.138 0.494 . . . . 0.0 110.067 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -126.59 101.62 6.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.958 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -161.18 -79.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.753 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -148.41 60.99 1.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.308 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -68.65 -19.22 64.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.536 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -81.51 -27.28 34.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.026 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.511 ' HB ' HD23 ' A' ' 93' ' ' LEU . 6.7 pt -86.11 -18.93 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-O 121.368 0.604 . . . . 0.0 109.547 175.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.596 HD23 ' HB2' ' A' ' 61' ' ' ALA . 2.7 tm? -65.72 -26.85 67.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.712 -173.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.663 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 2.6 m -60.32 -27.85 67.67 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.322 0.582 . . . . 0.0 110.698 178.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.646 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 8.8 tp10 -72.2 -14.69 61.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.406 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.58 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 58.1 t -87.91 -53.22 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.008 0.432 . . . . 0.0 110.484 172.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -55.48 -53.08 60.78 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -172.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' A' ' 71' ' ' SER . 1.5 mtp-105 -58.48 -51.73 79.72 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.686 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.724 ' HB3' ' SD ' ' A' ' 81' ' ' MET . 47.9 Cg_exo -61.52 -39.43 55.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.565 1.51 . . . . 0.0 113.361 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.5 ' HG3' ' HE2' ' A' ' 21' ' ' PHE . 23.8 mmt -61.81 -16.68 51.91 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.882 0.372 . . . . 0.0 111.281 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.546 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 40.6 t -75.31 -11.76 60.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.572 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 80' ' ' HIS . 9.9 p -136.95 168.67 21.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.409 ' H ' HG22 ' A' ' 79' ' ' VAL . 51.2 t60 -71.02 96.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.827 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -118.12 158.78 45.41 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.854 -163.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.827 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 25.0 Cg_exo -40.55 3.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.745 1 C-N-CA 127.831 5.687 . . . . 0.0 118.034 167.618 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.631 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -38.91 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -163.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.654 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -64.51 -48.56 74.7 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.955 1.252 . . . . 0.0 109.583 173.116 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.583 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 34.8 ttmt -66.29 -20.7 66.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.198 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.631 HD13 ' HA ' ' A' ' 83' ' ' ALA . 44.8 mt -66.22 -30.85 51.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.059 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 90' ' ' LEU . 50.0 t -78.46 -20.34 51.15 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.887 176.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.583 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 4.8 tp10 -64.34 -50.75 66.55 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 46.8 mtmt -63.17 -33.25 75.06 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.515 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 13.3 mt -61.87 -21.86 65.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.677 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.637 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 26.7 mtmm -64.61 -24.03 67.46 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.964 -176.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 92' ' ' LYS . 24.6 tptp -79.78 -19.09 49.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.205 0.526 . . . . 0.0 110.254 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.511 HD23 ' HB ' ' A' ' 69' ' ' ILE . 6.8 mp -85.87 -48.16 9.0 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -160.44 122.61 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.992 174.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -84.37 -14.01 50.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.007 0.432 . . . . 0.0 110.959 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -75.28 -14.29 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.488 HG12 ' HB3' ' A' ' 58' ' ' TYR . 83.3 mt -60.61 -33.05 53.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 122.001 0.905 . . . . 0.0 109.181 170.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.637 ' SG ' ' HG2' ' A' ' 91' ' ' LYS . 90.9 m -87.67 -51.4 5.9 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.597 -177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.09 43.94 1.04 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.195 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.551 ' O ' HG22 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -111.53 48.76 0.93 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -62.01 158.04 17.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.395 -172.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.443 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 71.2 m-85 -70.73 87.05 0.68 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.952 -178.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 68.57 90.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.003 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -94.69 110.68 22.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.29 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.5 p . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.652 -179.731 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER 71.59 149.97 0.09 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.33 0.586 . . . . 0.0 111.62 176.749 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.92 5.31 2.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.522 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 121.72 67.25 0.25 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.694 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.01 32.73 38.8 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.647 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? 52.58 65.85 5.6 Favored Pre-proline 0 N--CA 1.465 0.309 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -83.56 47.27 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.437 2.091 . . . . 0.0 111.01 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.927 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -66.77 -41.2 93.79 Favored Glycine 0 N--CA 1.439 -1.132 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.525 -169.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.599 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -179.51 -82.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.545 0.688 . . . . 0.0 110.953 -173.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -165.21 -70.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.635 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 p -68.33 128.92 38.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.429 175.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.675 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 34.2 mp0 -48.26 -76.92 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.829 HG12 HD23 ' A' ' 55' ' ' LEU . 59.3 t -51.73 -42.47 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.3 t -63.87 -46.23 85.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.073 0.463 . . . . 0.0 110.27 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.675 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.1 ptmt -68.96 -36.52 78.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.435 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.1 mm-40 -61.84 -51.38 68.47 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.096 -178.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -65.01 -54.51 29.29 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.334 -176.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.548 HD13 ' SG ' ' A' ' 87' ' ' CYS . 71.3 mt -58.08 -52.95 63.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -174.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.927 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -68.54 -36.2 78.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.937 0.399 . . . . 0.0 111.309 -175.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -73.68 -39.12 64.63 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.33 -178.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.529 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 87.3 t80 -61.84 -49.37 76.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.589 0.709 . . . . 0.0 109.241 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.438 ' O ' HG12 ' A' ' 26' ' ' ILE . 40.8 t80 -48.86 -47.89 42.41 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.05 178.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 2' ' ' GLU . 4.7 mmtp -77.57 -46.93 20.75 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.6 t -57.7 -29.03 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.092 0.473 . . . . 0.0 110.683 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 3.9 tp -72.03 -41.61 67.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.446 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 22' ' ' TYR . 40.7 mm -68.66 -36.67 75.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.488 0.661 . . . . 0.0 109.637 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.39 -45.67 86.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.387 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 28' ' ' ARG . 18.1 mtp180 -70.19 -26.1 63.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.404 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.95 12.44 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.564 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.658 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.41 126.7 71.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 114.749 -0.725 . . . . 0.0 109.339 -178.464 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.535 ' O ' HD13 ' A' ' 37' ' ' ILE . 2.0 t-20 -173.91 -45.18 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 175.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -79.54 47.36 0.82 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.335 0.588 . . . . 0.0 111.784 -173.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 37' ' ' ILE . 20.4 m -157.88 109.56 2.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.825 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.551 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.9 mm? -57.88 -41.64 82.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.977 -176.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -59.09 -41.95 89.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.232 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -70.72 -42.65 70.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.514 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 31' ' ' ASN . 67.3 mt -57.69 -37.39 59.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -71.16 -47.24 58.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.086 -178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.654 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -60.97 -43.38 98.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.449 ' HG3' HG23 ' A' ' 30' ' ' VAL . 4.8 mm-40 -78.55 -27.04 45.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -176.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.529 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 6.2 mt -59.28 -48.83 80.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.51 -47.27 85.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.67 175.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.5 m -60.05 -47.28 86.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.299 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -71.09 -38.51 72.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.48 -175.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.455 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 54.5 m -66.62 -28.65 68.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -86.02 -20.14 29.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.093 0.473 . . . . 0.0 110.641 176.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -87.47 -24.64 24.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.314 -175.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.747 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -70.13 -173.76 0.72 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.846 -179.445 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -96.34 174.36 6.91 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.284 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.01 -47.86 39.68 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 114.758 0.663 . . . . 0.0 114.758 -169.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -61.2 -36.35 79.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.258 0.529 . . . . 0.0 111.371 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.747 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.0 mt-10 -80.67 -38.75 28.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.094 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.1 -47.32 83.61 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -64.35 -38.5 91.25 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.735 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.829 HD23 HG12 ' A' ' 13' ' ' VAL . 34.1 tp -57.88 -36.87 72.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.5 m -70.92 -17.39 62.69 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.72 -29.7 67.16 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -86.17 -38.61 17.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.36 177.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.1 mt -73.22 -25.88 60.91 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.571 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.603 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 106.12 -9.52 42.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.487 174.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.479 ' HA ' HD12 ' A' ' 70' ' ' LEU . . . -81.78 55.85 2.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.724 0.773 . . . . 0.0 111.118 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 64' ' ' ASP . 24.8 m -156.82 140.71 16.19 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -75.68 19.72 0.19 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.039 0.447 . . . . 0.0 112.023 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.441 ' H ' ' C ' ' A' ' 62' ' ' THR . 1.2 m-20 -127.16 1.93 6.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.886 176.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.92 -174.16 2.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.775 -172.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.435 ' HB2' HG23 ' A' ' 69' ' ' ILE . . . -67.66 136.51 54.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.961 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 p -84.41 -35.52 23.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.854 -175.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -72.88 -22.49 60.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.07 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.603 HG22 ' HA3' ' A' ' 60' ' ' GLY . 18.1 tt -85.67 -24.92 6.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.256 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.479 HD12 ' HA ' ' A' ' 61' ' ' ALA . 21.2 tp -61.5 -43.55 98.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.439 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.587 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 16.0 p -68.57 -23.01 64.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -75.89 -19.94 58.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.652 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.428 ' O ' ' HG2' ' A' ' 77' ' ' MET . 48.3 t -88.73 -52.09 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.282 172.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.497 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 18.4 p -55.27 -49.45 72.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.587 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.0 mpt_? -55.46 -54.59 49.41 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -176.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.52 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 27.7 Cg_endo -66.49 -13.27 39.22 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.898 1.732 . . . . 0.0 114.41 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 24.4 mmt -77.25 -25.38 51.47 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.087 176.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 t -73.63 -13.97 61.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.202 -175.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.37 163.53 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.402 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 75.2 t60 -70.14 89.28 0.63 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.36 0.527 . . . . 0.0 110.201 178.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.52 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 5.3 mtp -110.29 176.86 1.37 Allowed Pre-proline 0 C--N 1.318 -0.767 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.337 -176.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.541 ' C ' HG13 ' A' ' 86' ' ' ILE . 33.1 Cg_exo -42.69 -0.17 0.01 OUTLIER 'Trans proline' 0 C--O 1.212 -0.801 1 C-N-CA 126.113 4.542 . . . . 0.0 116.904 171.162 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.652 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -38.55 -41.07 0.64 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.133 1.333 . . . . 0.0 114.052 -169.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.68 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -61.98 -56.87 14.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.043 0.925 . . . . 0.0 109.543 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 39.3 ttmt -62.07 -14.53 37.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.232 178.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.652 HD11 ' HA ' ' A' ' 83' ' ' ALA . 42.0 mt -70.51 -26.01 27.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 O-C-N 122.037 -0.414 . . . . 0.0 111.3 -177.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.548 ' SG ' HD13 ' A' ' 18' ' ' LEU . 84.8 m -73.05 -17.48 61.42 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.816 0.817 . . . . 0.0 110.213 173.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.509 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.9 mt-10 -85.94 -45.34 11.59 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.187 171.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 86' ' ' ILE . 26.4 ttpp -64.06 -38.18 90.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.384 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.19 -14.48 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -66.82 -14.92 63.21 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.953 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -67.36 -29.13 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.463 0.649 . . . . 0.0 109.56 173.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.407 HD12 ' N ' ' A' ' 93' ' ' LEU . 6.6 mp -94.23 -47.41 6.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.109 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -161.27 124.15 3.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.022 -179.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.4 p -86.82 -16.16 37.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.739 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.649 ' HA ' ' HG2' ' A' ' 99' ' ' GLU . 1.9 mp0 -72.15 -19.67 61.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.717 0.294 . . . . 0.0 111.346 -175.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.66 -30.8 22.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.332 0.587 . . . . 0.0 110.585 174.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 13.3 m -82.45 -24.76 34.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.592 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.649 ' HG2' ' HA ' ' A' ' 96' ' ' GLN . 11.8 pt-20 -100.6 20.65 14.69 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.45 -63.6 1.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.577 ' HB2' ' HA ' ' A' ' 104' ' ' LYS . 69.5 mmtt 66.19 131.7 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.748 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -67.12 101.03 0.83 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 65.03 33.59 9.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.699 -173.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.577 ' HA ' ' HB2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER 60.12 45.23 12.03 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.365 175.518 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.922 173.143 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.427 ' HB3' ' HD2' ' A' ' 20' ' ' ARG . 3.9 mm100 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.407 ' H ' ' HB2' ' A' ' 1' ' ' GLN . 6.4 mm-40 69.86 168.67 0.3 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 169.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.438 ' HB3' ' HG2' ' A' ' 23' ' ' LYS . . . -171.25 10.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 113.877 -1.51 . . . . 0.0 109.902 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.3 49.82 0.22 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.646 -0.788 . . . . 0.0 113.278 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 118.18 10.52 8.84 Favored Glycine 0 CA--C 1.516 0.142 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.923 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.643 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 5.5 tpt180 54.85 43.27 1.3 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 123.037 0.535 . . . . 0.0 112.327 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.643 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 64.6 Cg_endo -103.42 78.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.961 2.44 . . . . 0.0 112.472 -173.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.759 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -88.09 -23.17 38.89 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.883 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.531 ' N ' ' HG2' ' A' ' 15' ' ' LYS . . . 172.92 -129.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.33 -0.935 . . . . 0.0 108.487 -175.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -139.3 -33.38 0.62 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 169.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.607 ' HB3' ' O ' ' A' ' 98' ' ' CYS . 26.5 m -60.38 106.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.976 167.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -48.88 -69.52 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -165.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.508 HG13 ' HB2' ' A' ' 100' ' ' LEU . 14.3 p -59.46 -31.37 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.613 0.721 . . . . 0.0 110.52 -174.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 11' ' ' CYS . 51.2 t -69.88 -35.81 74.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.371 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.602 ' HG3' ' O ' ' A' ' 11' ' ' CYS . 55.9 mtpt -57.04 -53.79 54.05 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.266 0.555 . . . . 0.0 109.915 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.516 ' HB3' HH11 ' A' ' 20' ' ' ARG . 13.5 mm-40 -53.7 -51.78 62.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.318 -177.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.656 ' HE2' ' HA ' ' A' ' 45' ' ' CYS . 43.6 t80 -61.4 -55.44 31.38 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.86 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.95 -49.41 77.55 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -174.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.759 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 25.5 t-20 -68.56 -46.8 68.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.354 -174.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.516 HH11 ' HB3' ' A' ' 16' ' ' GLU . 46.2 mtp180 -63.18 -41.27 99.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.114 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.03 -48.67 80.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.622 0.725 . . . . 0.0 109.827 175.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.621 ' HE2' ' H ' ' A' ' 81' ' ' MET . 47.9 t80 -51.91 -55.85 17.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.201 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.601 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -73.51 -30.23 62.99 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.329 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.601 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 71.9 m -64.62 -45.85 85.13 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 121.205 -0.198 . . . . 0.0 110.47 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.2 mp -63.46 -41.41 98.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.588 0.233 . . . . 0.0 111.36 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 22' ' ' TYR . 39.7 mm -67.23 -40.03 84.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.057 0.456 . . . . 0.0 110.278 177.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.57 -44.94 73.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.148 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 28' ' ' ARG . 10.2 mtp180 -72.04 -15.26 62.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.1 39.43 27.39 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.508 HG21 ' HG3' ' A' ' 40' ' ' GLU . 0.7 OUTLIER -130.92 98.76 3.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.204 0.526 . . . . 0.0 110.123 -177.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.404 HD21 ' HA ' ' A' ' 31' ' ' ASN . 1.4 t-20 -168.49 -177.83 3.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.057 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 57.3 31.98 21.01 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.289 0.566 . . . . 0.0 111.515 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.585 ' O ' HG12 ' A' ' 37' ' ' ILE . 62.8 m -150.75 107.56 3.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 176.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.67 HD12 ' HE ' ' A' ' 75' ' ' ARG . 95.1 mt -60.09 -41.64 92.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.391 -170.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -67.59 -28.94 68.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.257 0.551 . . . . 0.0 109.874 -178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 m -78.14 -37.5 45.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.859 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 33' ' ' SER . 17.0 mm -64.6 -32.54 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.466 ' CG ' HG23 ' A' ' 74' ' ' THR . 41.1 mt-10 -66.01 -23.68 66.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.694 178.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -85.77 -52.48 5.74 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.147 0.498 . . . . 0.0 110.382 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.508 ' HG3' HG21 ' A' ' 30' ' ' VAL . 7.1 mm-40 -71.64 -25.9 62.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.46 -171.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.626 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 7.3 mt -58.45 -38.38 77.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 171.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.1 mt -74.71 -45.96 43.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.144 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 m -57.58 -45.21 85.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.177 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -78.3 -32.93 49.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.954 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.656 ' HA ' ' HE2' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -73.06 -19.41 61.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.342 0.591 . . . . 0.0 110.14 -179.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.0 tp -86.35 -41.23 14.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.044 170.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.73 63.61 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.661 0.743 . . . . 0.0 110.492 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.728 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -158.71 -172.42 3.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.595 -179.146 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -98.71 171.49 8.07 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.061 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.69 -43.88 38.12 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 123.644 0.59 . . . . 0.0 114.573 -171.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 7.7 tptp -63.09 -35.36 80.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.312 0.577 . . . . 0.0 110.681 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.728 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 16.0 mt-10 -85.48 -36.43 20.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.242 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.562 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 14.1 m120 -61.39 -39.06 89.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.552 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.491 ' HA ' ' HD2' ' A' ' 54' ' ' ARG . 19.7 tpt180 -75.08 -35.72 61.79 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.1 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.564 HD13 HD12 ' A' ' 100' ' ' LEU . 49.6 tp -58.66 -25.18 62.51 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.333 0.587 . . . . 0.0 110.361 175.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.562 ' HB3' ' O ' ' A' ' 53' ' ' ASN . 13.2 t -62.29 -32.38 73.09 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.391 176.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -74.91 -17.92 60.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 0.0 109.807 177.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.66 ' HB3' HG12 ' A' ' 97' ' ' ILE . 84.8 m-85 -86.08 -55.13 4.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.904 176.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.8 -18.36 65.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.621 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 82.64 36.13 17.37 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.416 175.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.425 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . . . -93.63 16.87 12.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.215 0.531 . . . . 0.0 110.587 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.492 HG22 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -132.91 128.58 36.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.468 178.097 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HA ' HG23 ' A' ' 67' ' ' THR . 54.9 mtpt -76.91 -10.3 59.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.182 0.515 . . . . 0.0 110.262 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -74.86 -14.82 60.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.039 174.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.29 -139.65 0.32 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.872 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.63 102.04 0.06 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.158 0.504 . . . . 0.0 109.93 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.442 HG23 ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -86.39 -37.84 17.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.149 -169.298 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -72.28 -35.96 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.511 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.621 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.3 tt -64.12 -23.85 34.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.266 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.97 -49.95 70.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.442 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 8.0 m -66.48 -27.19 67.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.753 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -75.29 -21.51 58.44 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.064 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.545 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.0 t -87.21 -41.91 14.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.943 173.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.466 HG23 ' CG ' ' A' ' 38' ' ' GLU . 39.7 p -60.68 -42.03 96.3 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.67 ' HE ' HD12 ' A' ' 34' ' ' LEU . 4.3 mpt_? -55.69 -53.47 62.36 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.517 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.545 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 31.8 Cg_exo -62.52 -45.78 13.56 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.865 1.71 . . . . 0.0 112.828 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 14.3 mmt -62.78 -14.81 49.5 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.4 t -66.79 -14.45 62.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.423 179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.02 162.26 34.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -61.63 107.1 0.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 175.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.85 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -119.68 153.42 54.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -163.166 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.85 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 24.9 Cg_exo -40.56 3.48 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.952 1 C-N-CA 127.923 5.749 . . . . 0.0 117.919 167.183 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.678 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.59 -31.7 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 115.618 1.71 . . . . 0.0 115.618 -164.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.482 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -50.93 -49.32 60.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.462 0.648 . . . . 0.0 110.257 173.158 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 18.0 ptpt -85.81 -15.16 42.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.474 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.792 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 15.2 mt -59.39 -42.67 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.538 ' HA ' HD11 ' A' ' 90' ' ' LEU . 19.4 t -67.32 -22.07 65.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.286 0.565 . . . . 0.0 111.102 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 15.5 tp10 -76.41 -44.16 37.25 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.792 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 10.1 mtmp? -61.11 -24.96 66.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.17 176.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.538 HD11 ' HA ' ' A' ' 87' ' ' CYS . 23.1 mt -66.75 -17.82 65.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.264 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -63.53 -20.62 65.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.782 0.325 . . . . 0.0 110.806 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -69.04 -29.51 67.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.181 0.515 . . . . 0.0 110.333 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.56 -59.49 2.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.321 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -151.33 134.2 15.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.345 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.9 m -85.24 -19.55 31.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.465 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -68.07 -30.87 70.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.894 0.378 . . . . 0.0 110.668 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.66 HG12 ' HB3' ' A' ' 58' ' ' TYR . 20.2 mt -56.55 -33.55 39.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.234 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.607 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 53.7 t -75.04 -35.98 61.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.748 -174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -85.99 -107.92 0.05 Allowed 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.298 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.564 HD12 HD13 ' A' ' 55' ' ' LEU . 73.7 mt 64.39 -69.45 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.888 0.475 . . . . 0.0 111.059 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 70.2 149.25 0.08 Allowed 'General case' 0 C--O 1.231 0.119 0 O-C-N 123.931 0.769 . . . . 0.0 110.836 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -73.06 -47.4 44.99 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.357 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -130.28 -17.84 3.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.101 -178.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 63.53 39.05 9.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.653 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.661 178.649 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 N--CA 1.478 0.938 0 CA-C-O 121.513 0.673 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.743 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 7.9 mp0 -141.42 -168.4 2.63 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -175.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 6' ' ' ARG . . . -116.85 -87.33 0.61 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 166.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.83 -99.72 0.1 OUTLIER Glycine 0 CA--C 1.517 0.184 0 C-N-CA 121.149 -0.548 . . . . 0.0 112.607 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.43 -27.62 73.68 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 174.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.579 ' HB2' ' HA ' ' A' ' 3' ' ' ALA . 30.7 mtm180 -73.18 141.74 81.37 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -90.1 86.99 0.37 Allowed 'Trans proline' 0 N--CA 1.444 -1.436 0 C-N-CA 123.175 2.584 . . . . 0.0 111.226 -171.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.586 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -76.14 -29.94 57.91 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 119.065 -1.541 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.447 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.43 -94.08 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.481 -0.86 . . . . 0.0 109.201 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.425 ' HB3' ' CD ' ' A' ' 88' ' ' GLU . 19.3 t70 -164.25 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 170.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 92.5 m -59.8 166.72 2.47 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.402 166.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 40.2 tt0 -89.77 -77.73 0.38 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -167.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.83 HG11 HD21 ' A' ' 55' ' ' LEU . 59.6 t -55.04 -42.57 65.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.289 0.566 . . . . 0.0 111.322 -170.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.666 ' HA ' HD22 ' A' ' 55' ' ' LEU . 20.8 t -63.51 -36.0 82.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.73 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.525 ' HG3' ' N ' ' A' ' 16' ' ' GLU . 2.5 ptpp? -69.25 -35.61 76.29 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.68 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.525 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 61.7 mm-40 -56.88 -55.15 38.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.628 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -57.42 -55.04 39.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.821 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.562 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.0 mt -61.5 -38.84 88.78 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.048 -173.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -64.45 -55.36 21.39 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.17 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.743 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 0.9 OUTLIER -53.57 -55.56 24.6 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 176.132 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.24 -50.71 61.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.529 0.68 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.563 ' O ' HG12 ' A' ' 26' ' ' ILE . 54.9 t80 -53.79 -55.27 27.95 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 113.998 -1.456 . . . . 0.0 111.257 -178.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.637 ' HB2' ' HZ2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.95 -34.02 59.84 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.527 -176.233 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 75.2 m -58.29 -46.26 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.664 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.594 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 2.4 mp -66.33 -44.91 81.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.072 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 22' ' ' TYR . 48.6 mm -59.88 -38.69 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.608 177.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -64.1 -39.38 93.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.864 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.493 ' HB3' HG21 ' A' ' 30' ' ' VAL . 32.6 mtm180 -83.23 -14.85 52.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.115 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.0 15.35 62.99 Favored Glycine 0 N--CA 1.453 -0.177 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.594 ' HB ' ' HG ' ' A' ' 25' ' ' LEU . 43.7 t -93.74 106.0 17.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 114.245 -0.978 . . . . 0.0 110.043 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.692 ' HA ' HD11 ' A' ' 37' ' ' ILE . 1.0 OUTLIER -164.43 -55.26 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 118.499 -1.28 . . . . 0.0 114.212 176.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.443 ' HA ' ' HG ' ' A' ' 78' ' ' SER . 19.4 t80 -78.74 59.04 2.43 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.637 0.732 . . . . 0.0 110.575 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.795 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 13.5 m -157.95 101.65 1.79 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.063 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.45 -46.74 76.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.807 -176.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.93 -30.68 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.279 0.561 . . . . 0.0 110.47 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.795 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 51.6 m -76.02 -46.33 29.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.498 -177.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.692 HD11 ' HA ' ' A' ' 31' ' ' ASN . 32.3 mm -58.52 -33.8 49.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -63.27 -50.71 69.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.884 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -65.21 -39.0 92.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.357 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.492 ' HG3' HG12 ' A' ' 30' ' ' VAL . 53.6 mm-40 -70.19 -40.64 74.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.299 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.563 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 16.8 mt -55.5 -55.54 30.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 59.2 mt -54.76 -47.43 74.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.429 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.4 m -63.93 -51.27 65.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.503 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -67.05 -35.37 79.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.052 0.453 . . . . 0.0 110.353 -176.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 61' ' ' ALA . 60.7 m -66.97 -33.63 75.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.243 -179.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 46' ' ' LEU . 4.1 mm? -87.63 -20.73 25.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.904 0.383 . . . . 0.0 111.419 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.68 -31.57 61.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.062 0.458 . . . . 0.0 111.262 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -69.66 -170.42 0.3 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.876 -178.255 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -95.82 171.18 8.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.113 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -42.68 43.63 Favored Glycine 0 N--CA 1.453 -0.205 0 O-C-N 123.687 0.617 . . . . 0.0 114.408 -169.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 14.8 tptt -61.81 -39.27 91.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.519 0.676 . . . . 0.0 110.317 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.0 mt-10 -80.81 -35.99 32.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.36 -175.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.444 HD22 ' C ' ' A' ' 48' ' ' THR . 3.9 m120 -63.42 -43.41 97.58 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.565 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 12.6 tpt180 -63.12 -37.38 86.97 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.661 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.83 HD21 HG11 ' A' ' 13' ' ' VAL . 61.6 tp -56.18 -45.09 79.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.633 176.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.524 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 57.3 m -71.01 -14.52 62.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.067 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.565 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 9.9 m-85 -65.45 -32.21 73.71 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 172.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.533 ' HB3' HG12 ' A' ' 97' ' ' ILE . 91.1 m-85 -85.74 -39.11 17.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.267 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 95.8 mt -66.84 -19.84 65.81 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.891 177.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.546 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 86.79 12.12 69.46 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.023 174.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -98.55 19.12 15.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.064 0.459 . . . . 0.0 111.894 -174.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.1 p -102.06 160.51 14.45 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -75.74 -4.7 41.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -168.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -124.4 19.55 8.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.12 0.486 . . . . 0.0 110.318 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.74 -178.3 3.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.775 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.69 119.39 18.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.59 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.5 p -74.06 -17.3 60.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.771 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -58.46 -50.5 73.51 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.546 HG23 ' HA3' ' A' ' 60' ' ' GLY . 12.9 tt -75.44 -31.08 23.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.184 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.0 tt -56.3 -55.16 36.82 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.452 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 8.1 p -67.03 -29.62 69.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.072 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.48 -22.74 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.03 0.443 . . . . 0.0 110.41 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.672 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 98.1 t -85.81 -48.81 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.484 175.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.514 HG23 HG23 ' A' ' 37' ' ' ILE . 41.3 p -61.01 -36.91 80.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 71' ' ' SER . 2.1 mpp_? -54.47 -56.07 30.73 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.546 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.672 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 11.8 Cg_exo -71.67 -36.72 6.1 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.579 1.52 . . . . 0.0 112.436 174.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.401 ' HB2' ' HA ' ' A' ' 74' ' ' THR . 3.8 mmt -59.46 -20.52 55.77 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.443 ' HG ' ' HA ' ' A' ' 32' ' ' PHE . 41.1 t -60.8 -13.64 16.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -177.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.3 m -126.45 174.74 9.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -64.89 88.21 0.06 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.787 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 14.1 tpt -103.28 149.58 37.1 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -162.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.787 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 23.4 Cg_exo -41.41 3.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 127.771 5.647 . . . . 0.0 117.978 168.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' A' ' 81' ' ' MET . . . -37.44 -27.52 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -165.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.586 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -53.12 -49.0 67.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.808 0.813 . . . . 0.0 109.476 171.615 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 82' ' ' PRO . 41.1 mtmt -74.01 -30.41 62.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.315 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.537 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 39.6 mt -60.53 -41.44 87.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.942 -174.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.562 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 43.9 t -63.07 -33.0 74.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.318 0.58 . . . . 0.0 110.93 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.425 ' CD ' ' HB3' ' A' ' 10' ' ' ASP . 69.6 mm-40 -74.81 -36.07 62.47 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.119 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.18 -28.24 66.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.015 175.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.435 ' HA ' HD11 ' A' ' 93' ' ' LEU . 28.8 mt -71.04 -15.77 62.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.302 177.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -69.8 -16.12 63.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 0.0 110.334 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -68.92 -24.95 64.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.6 176.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.435 HD11 ' HA ' ' A' ' 90' ' ' LEU . 7.0 mp -80.91 -53.53 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.719 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.49 ' HB3' HG13 ' A' ' 97' ' ' ILE . 24.2 t70 -164.66 143.16 6.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.846 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.2 p -79.34 -22.75 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -173.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -73.12 -20.29 60.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.533 HG12 ' HB3' ' A' ' 58' ' ' TYR . 10.1 mt -62.97 -33.1 58.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.177 -178.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.615 ' HA ' ' HB2' ' A' ' 14' ' ' CYS . 12.4 p -104.63 -28.45 11.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.855 0.36 . . . . 0.0 110.935 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HB3' ' H ' ' A' ' 100' ' ' LEU . 29.4 tt0 -76.12 -94.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.169 -171.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.443 HD12 HD11 ' A' ' 55' ' ' LEU . 25.3 mt 65.71 -63.56 0.21 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.807 0.692 . . . . 0.0 111.948 -177.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 71.01 123.59 0.03 OUTLIER 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.658 0.783 . . . . 0.0 111.192 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -63.2 154.79 30.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.775 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.9 95.45 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.777 0.673 . . . . 0.0 111.577 -172.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.634 ' H ' ' HD3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -93.1 0.58 57.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.954 179.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.25 1.083 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.036 178.437 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.658 ' HG2' ' HE2' ' A' ' 22' ' ' TYR . 19.3 mt-30 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.467 ' OE1' ' HE3' ' A' ' 23' ' ' LYS . 42.2 mt-10 68.56 -50.22 0.57 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.889 0.876 . . . . 0.0 112.246 -173.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.81 148.07 46.61 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.607 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 114.13 36.3 1.37 Allowed Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 -176.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.35 30.51 71.4 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.192 -0.527 . . . . 0.0 112.015 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 18.2 mmm180 56.87 68.46 2.11 Favored Pre-proline 0 N--CA 1.462 0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.318 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.32 51.94 0.8 Allowed 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 123.01 2.473 . . . . 0.0 111.512 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.75 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -65.73 -34.11 87.89 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.456 -0.878 . . . . 0.0 110.931 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.79 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -176.01 -136.64 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.228 -0.986 . . . . 0.0 108.638 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -121.8 -52.62 2.0 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.616 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 3.1 m -54.8 95.42 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.221 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.526 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 42.0 tp10 -41.14 -58.0 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -168.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.85 HG13 HD21 ' A' ' 55' ' ' LEU . 36.4 t -60.49 -52.36 62.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.131 0.491 . . . . 0.0 111.191 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.724 ' HA ' HD22 ' A' ' 55' ' ' LEU . 3.0 t -62.49 -35.73 80.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.495 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.546 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 3.3 ttmt -56.46 -52.74 63.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.795 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.503 ' N ' ' HG2' ' A' ' 15' ' ' LYS . 55.2 mm-40 -56.57 -48.94 76.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.628 178.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -57.37 -50.44 72.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.747 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 87' ' ' CYS . 98.0 mt -58.83 -55.93 28.72 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -175.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.75 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -66.23 -39.86 89.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.684 0.278 . . . . 0.0 111.311 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 -68.05 -36.38 79.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.697 0.284 . . . . 0.0 110.557 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.94 -46.45 68.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.805 0.812 . . . . 0.0 109.427 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.658 ' HE2' ' HG2' ' A' ' 1' ' ' GLN . 86.1 t80 -48.48 -52.88 20.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.521 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.627 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -74.4 -36.38 63.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.627 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 72.2 m -63.73 -31.81 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.49 HD21 ' ND2' ' A' ' 31' ' ' ASN . 1.1 tp -75.84 -24.01 55.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.768 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 22' ' ' TYR . 45.2 mm -84.07 -37.09 12.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -56.35 -54.9 40.07 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.249 172.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -78.23 -20.5 51.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.838 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.73 28.37 70.94 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.285 174.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.51 HG23 ' HG3' ' A' ' 40' ' ' GLU . 1.0 OUTLIER -100.1 9.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 122.402 1.096 . . . . 0.0 110.073 -176.332 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.49 ' ND2' HD21 ' A' ' 25' ' ' LEU . 2.4 t-20 -88.45 8.33 28.44 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.991 -1.459 . . . . 0.0 112.388 -164.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -108.14 8.4 28.03 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.48 -177.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 37' ' ' ILE . 14.8 m -124.94 118.72 26.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.002 175.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -62.03 -41.17 97.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.268 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -66.1 -29.29 69.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.583 0.706 . . . . 0.0 109.767 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.9 m -76.59 -42.75 41.43 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.522 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 33' ' ' SER . 73.0 mt -58.12 -34.96 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.449 ' O ' HG13 ' A' ' 42' ' ' ILE . 35.7 tt0 -63.86 -52.32 60.58 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.834 178.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -67.5 -36.22 80.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.071 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.51 ' HG3' HG23 ' A' ' 30' ' ' VAL . 8.5 mm-40 -67.36 -38.16 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.382 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.516 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 20.1 tp -60.28 -36.39 77.72 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 38' ' ' GLU . 85.9 mt -67.79 -50.54 59.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.714 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -59.39 -42.77 92.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.408 -179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.35 -32.79 72.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.153 0.501 . . . . 0.0 109.837 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 2.2 t -68.29 -31.87 71.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.327 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.5 tp -85.27 -30.97 23.36 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.266 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -97.1 51.99 1.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.823 0.82 . . . . 0.0 110.551 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.686 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -141.93 -170.13 3.07 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.23 178.073 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.481 ' HD2' ' N ' ' A' ' 49' ' ' LYS . 10.8 mptt -97.16 166.12 11.73 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.536 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.32 -43.29 19.36 Favored Glycine 0 C--N 1.329 0.187 0 O-C-N 123.876 0.735 . . . . 0.0 114.471 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.672 ' HZ1' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -61.55 -36.33 80.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.103 0.477 . . . . 0.0 110.716 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.686 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.3 mt-10 -85.09 -34.76 22.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.158 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.27 -43.31 96.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 23.2 tpt180 -72.25 -35.2 68.74 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.488 177.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.85 HD21 HG13 ' A' ' 13' ' ' VAL . 57.8 tp -56.35 -39.05 72.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.384 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.701 ' SG ' HG22 ' A' ' 62' ' ' THR . 0.5 OUTLIER -71.28 -15.07 62.41 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.139 -176.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.463 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.1 m-85 -66.32 -34.23 77.51 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.163 0.506 . . . . 0.0 109.665 174.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.492 ' HB3' ' HB ' ' A' ' 97' ' ' ILE . 24.1 m-85 -83.3 -23.77 32.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.712 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.499 ' CD2' HD13 ' A' ' 97' ' ' ILE . 22.5 mt -79.38 -19.33 50.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.15 173.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.588 ' HA2' ' HB3' ' A' ' 65' ' ' ALA . . . 92.78 0.32 69.16 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 113.475 175.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.516 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -60.95 -33.73 73.64 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -172.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.701 HG22 ' SG ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -74.26 -8.37 56.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.403 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm 68.69 -7.16 0.75 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.145 0.578 . . . . 0.0 111.403 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 62' ' ' THR . 19.6 t70 -72.03 -23.96 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.863 0.84 . . . . 0.0 109.245 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.588 ' HB3' ' HA2' ' A' ' 60' ' ' GLY . . . -90.94 -167.52 1.84 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.69 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.64 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -62.84 133.29 54.49 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.091 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.56 -21.3 52.72 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.505 ' HB3' ' HZ2' ' A' ' 68' ' ' LYS . 6.2 ttpm? -77.85 -26.26 49.26 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.949 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' ' 66' ' ' ALA . 15.0 pt -76.35 -22.87 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 120.964 0.411 . . . . 0.0 110.203 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.34 -48.68 72.16 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.697 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 18.9 m -63.16 -34.17 77.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.218 174.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.416 ' HB3' ' O ' ' A' ' 69' ' ' ILE . 12.4 tp10 -53.74 -33.52 55.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.236 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.69 -53.57 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.324 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.612 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 41.8 p -58.92 -33.56 70.71 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.697 ' HG2' ' O ' ' A' ' 71' ' ' SER . 21.6 mmt180 -64.43 -57.45 17.29 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.214 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.51 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 49.3 Cg_endo -71.11 -15.62 32.07 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.857 1.704 . . . . 0.0 112.74 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.8 mmt -73.05 -19.98 61.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.419 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 37' ' ' ILE . 23.5 t -61.78 -13.61 25.27 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.778 HG13 ' HG3' ' A' ' 81' ' ' MET . 13.3 p -153.48 148.26 13.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -48.07 111.83 0.49 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.041 0.448 . . . . 0.0 110.424 176.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.778 ' HG3' HG13 ' A' ' 79' ' ' VAL . 21.6 mtp -144.7 178.98 1.26 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -166.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.583 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 33.8 Cg_exo -37.43 1.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.189 1 C-N-CA 127.92 5.747 . . . . 0.0 118.535 170.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.568 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.28 -38.35 0.22 Allowed 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.838 1.199 . . . . 0.0 113.892 -170.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.79 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -51.76 -50.33 60.85 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.4 . . . . 0.0 111.128 176.313 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.657 ' H ' ' HG2' ' A' ' 84' ' ' MET . 6.3 ptmt -88.2 -14.63 38.08 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.237 -0.29 . . . . 0.0 111.377 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.568 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 31.2 mt -59.71 -44.1 92.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.614 0.245 . . . . 0.0 110.846 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.833 ' HB2' HD12 ' A' ' 18' ' ' LEU . 42.6 t -65.89 -21.13 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.276 0.56 . . . . 0.0 111.211 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -82.88 -34.71 26.64 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.0 mttt -62.67 -31.42 72.3 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.478 0.656 . . . . 0.0 109.812 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 74.1 mt -66.74 -14.8 63.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.951 -177.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.572 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 41.7 mtpt -67.2 -17.49 64.84 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.698 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -66.15 -29.77 70.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.563 . . . . 0.0 109.689 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 60.1 mt -90.42 -50.22 6.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.101 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.572 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 16.6 t70 -147.71 132.42 17.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.067 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.3 m -87.44 -20.79 26.12 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.1 tp60 -78.89 -30.12 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.739 -174.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.499 HD13 ' CD2' ' A' ' 59' ' ' LEU . 10.3 tt -54.25 -29.18 19.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.854 0.835 . . . . 0.0 110.109 173.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.616 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 45.1 t -86.3 -58.71 2.52 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.624 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -96.17 42.89 1.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.798 -173.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.2 tp -70.57 -56.63 6.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.956 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 69.38 135.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 O-C-N 124.122 0.889 . . . . 0.0 112.016 177.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -68.2 157.76 34.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.683 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -83.0 75.37 9.89 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.398 0.618 . . . . 0.0 110.549 -177.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -74.86 46.83 0.31 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.393 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 39.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.079 -178.81 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.605 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 0.2 OUTLIER -165.17 153.9 12.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.822 -166.32 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.746 ' HB3' ' HA ' ' A' ' 16' ' ' GLU . . . -121.16 1.99 10.34 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.846 0.355 . . . . 0.0 110.487 176.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.2 105.99 1.38 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.469 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 106.07 -12.33 44.85 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.466 -175.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.418 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 41.1 mtt-85 -97.42 165.97 14.61 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -85.87 73.23 3.8 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.815 2.344 . . . . 0.0 109.999 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.934 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -78.65 -39.87 20.03 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.4 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.718 ' HB3' ' CB ' ' A' ' 87' ' ' CYS . . . -173.67 -90.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.834 0.35 . . . . 0.0 110.347 -176.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -152.58 -71.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.579 ' HB2' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -81.18 146.52 30.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -46.78 -56.79 5.65 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -171.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.824 HG12 HD22 ' A' ' 55' ' ' LEU . 58.7 t -61.13 -50.98 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 117.958 0.345 . . . . 0.0 111.742 -173.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.472 ' HA ' HD23 ' A' ' 55' ' ' LEU . 49.9 t -60.62 -33.87 73.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.525 0.678 . . . . 0.0 109.913 176.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.805 ' HG3' ' HA3' ' A' ' 8' ' ' GLY . 24.0 ttmt -67.17 -48.8 66.88 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.282 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.746 ' HA ' ' HB3' ' A' ' 3' ' ' ALA . 1.5 mm-40 -57.67 -42.93 84.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.843 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -66.35 -57.01 8.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 80.0 mt -67.18 -39.05 86.35 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.157 -173.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.934 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 27.3 t-20 -68.7 -55.9 9.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -176.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.605 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 67.1 mtm180 -64.28 -32.95 74.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.433 0.161 . . . . 0.0 111.433 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -64.12 -47.28 80.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.982 0.896 . . . . 0.0 109.622 174.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 49.8 t80 -57.96 -55.94 28.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.868 -177.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' HE2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -71.46 -26.84 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.259 -176.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.408 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 46.1 t -65.91 -47.56 74.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.923 0.392 . . . . 0.0 110.2 176.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -60.07 -48.37 82.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.605 -179.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 22' ' ' TYR . 43.3 mm -62.2 -45.51 98.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.702 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -70.75 -38.13 73.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.374 -177.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HB2' HG11 ' A' ' 30' ' ' VAL . 60.0 mtm180 -76.32 -13.64 60.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 111.726 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.51 38.31 57.85 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.692 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 1.9 p -125.07 91.31 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.295 -0.452 . . . . 0.0 110.042 -176.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -168.88 -170.29 1.14 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.026 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 62.38 35.11 15.17 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.603 ' O ' HG12 ' A' ' 37' ' ' ILE . 47.2 m -155.28 101.15 2.2 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.47 HD12 ' HD2' ' A' ' 75' ' ' ARG . 3.2 mm? -47.16 -43.94 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.16 -46.63 85.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.642 . . . . 0.0 110.458 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.6 m -71.14 -35.48 71.71 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.673 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.603 HG12 ' O ' ' A' ' 33' ' ' SER . 14.9 mm -55.4 -34.27 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.089 0.471 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -61.36 -47.79 84.26 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.914 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -66.63 -36.78 83.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.097 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -60.94 -53.28 59.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.494 HD11 ' HA ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -57.42 -41.26 80.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.67 0.271 . . . . 0.0 110.692 177.611 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.01 -44.89 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.592 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.2 m -58.74 -46.32 87.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.024 0.44 . . . . 0.0 110.34 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -76.12 -17.45 59.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.6 t -69.01 -47.83 64.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.835 177.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 46' ' ' LEU . 3.8 mm? -86.47 -31.22 21.47 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -72.09 -22.88 61.28 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.745 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.04 -164.29 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -98.62 173.11 7.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.305 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.89 -47.23 39.89 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 114.659 0.623 . . . . 0.0 114.659 -169.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.9 mptt -60.9 -37.06 80.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 117.153 0.476 . . . . 0.0 110.967 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.745 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 30.6 mt-10 -81.61 -34.79 30.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.888 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 7.1 m120 -65.94 -23.9 66.7 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.401 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 9.2 tpp180 -86.92 -35.04 19.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.235 0.54 . . . . 0.0 109.694 172.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.824 HD22 HG12 ' A' ' 13' ' ' VAL . 29.8 tp -60.99 -36.39 79.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.333 -179.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.54 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 21.6 p -65.72 -20.29 66.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.332 -178.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 45.7 m-85 -68.64 -30.94 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.479 ' HB3' HG13 ' A' ' 97' ' ' ILE . 91.0 m-85 -85.3 -45.24 12.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.53 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 97' ' ' ILE . 88.9 mt -68.7 -12.61 61.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.564 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.837 ' HA3' HG21 ' A' ' 69' ' ' ILE . . . 77.04 40.49 24.87 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.095 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.54 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . . . -107.57 25.1 11.9 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.613 0.721 . . . . 0.0 110.281 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.1 t -149.03 141.76 24.54 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.295 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -80.04 -3.22 47.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 -174.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -92.88 7.95 41.73 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.16 -161.65 1.11 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.78 109.97 0.58 Allowed 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.443 0.464 . . . . 0.0 109.964 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -15.27 50.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.343 -173.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -66.5 -44.71 81.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.358 . . . . 0.0 110.568 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.837 HG21 ' HA3' ' A' ' 60' ' ' GLY . 16.7 tt -72.29 -21.52 20.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.756 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.1 tt -61.15 -46.9 88.63 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.477 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 8.6 m -66.36 -28.51 68.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.719 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.407 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 8.5 mm-40 -67.65 -58.26 4.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.708 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.578 ' O ' ' HB2' ' A' ' 77' ' ' MET . 60.9 t -62.32 -44.29 99.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.798 0.333 . . . . 0.0 111.6 -173.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.475 ' HA ' HG21 ' A' ' 37' ' ' ILE . 16.4 p -56.59 -32.56 65.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -176.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -61.32 -56.75 30.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.267 -175.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.924 ' HB2' ' HG2' ' A' ' 81' ' ' MET . 72.6 Cg_endo -78.77 -27.49 4.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 121.706 1.604 . . . . 0.0 113.444 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.578 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 0.3 OUTLIER -67.21 -19.21 65.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.801 0.334 . . . . 0.0 110.795 -178.067 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.8 t -68.34 -13.36 62.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.547 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.716 HG21 ' H ' ' A' ' 80' ' ' HIS . 5.9 p -129.23 179.25 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.716 ' H ' HG21 ' A' ' 79' ' ' VAL . 14.9 t-80 -55.02 -67.86 0.24 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 122.501 0.32 . . . . 0.0 110.226 -178.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.924 ' HG2' ' HB2' ' A' ' 76' ' ' PRO . 15.4 tpt 67.39 145.71 0.1 Allowed Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 164.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.838 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 42.5 Cg_exo -43.74 4.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.949 1 C-N-CA 127.661 5.574 . . . . 0.0 118.251 168.399 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.623 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -35.21 -31.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -158.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.813 ' SD ' ' HG3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.75 -45.18 83.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 120.028 1.285 . . . . 0.0 109.997 175.239 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.813 ' HG3' ' SD ' ' A' ' 84' ' ' MET . 90.1 mttt -63.82 -24.2 67.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.148 176.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.749 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 32.7 mt -61.76 -27.38 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.896 -174.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.718 ' CB ' ' HB3' ' A' ' 9' ' ' ALA . 18.6 t -75.59 -31.56 59.99 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.57 176.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.535 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 4.5 mm-40 -63.35 -43.24 98.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.185 173.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 0.0 OUTLIER -68.57 -33.94 74.95 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.415 176.084 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 15.5 mt -64.3 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.283 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 54.2 mtpt -67.33 -17.13 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.072 0.463 . . . . 0.0 110.854 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.407 ' HB3' ' O ' ' A' ' 89' ' ' LYS . 58.0 tttm -76.69 -25.53 53.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.772 175.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.65 -52.54 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.736 175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.648 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 11.7 t70 -139.49 134.19 31.93 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.051 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 m -85.71 -30.36 23.21 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -86.27 -14.82 42.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.587 HD13 HD21 ' A' ' 59' ' ' LEU . 14.5 tt -59.7 -27.61 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.027 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 45.4 t -83.12 -30.93 27.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.679 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.28 -94.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.398 -171.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.64 -68.28 0.12 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.544 0.528 . . . . 0.0 110.582 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.487 ' HB2' ' HD3' ' A' ' 104' ' ' LYS . 33.4 mmtp 64.24 117.32 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.668 0.747 . . . . 0.0 111.81 177.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.509 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 89.5 m-85 -59.95 -53.11 61.69 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.894 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -133.14 145.13 50.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.049 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HD3' ' HB2' ' A' ' 101' ' ' LYS . 15.8 pttm -156.89 20.34 0.32 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.412 0.625 . . . . 0.0 110.402 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.25 1.09 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.371 176.955 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.772 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 4.2 pt20 . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.816 ' HA ' ' HD2' ' A' ' 6' ' ' ARG . 8.4 tp10 73.4 146.83 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 123.854 0.721 . . . . 0.0 111.365 175.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.8 47.39 0.49 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.9 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 72.45 58.47 4.99 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.602 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.51 55.25 6.18 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -173.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.816 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -43.0 105.86 0.45 Allowed Pre-proline 0 N--CA 1.463 0.192 0 CA-C-O 121.984 0.897 . . . . 0.0 112.691 -170.754 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.607 ' O ' ' HB3' ' A' ' 84' ' ' MET . 56.7 Cg_endo -89.65 63.46 2.21 Favored 'Trans proline' 0 N--CA 1.443 -1.446 0 C-N-CA 123.228 2.619 . . . . 0.0 110.184 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.627 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -73.77 -27.8 66.33 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.119 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 87' ' ' CYS . . . 177.78 -125.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 O-C-N 124.028 0.487 . . . . 0.0 110.624 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -128.41 -63.56 0.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.9 m -70.17 124.66 24.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.243 171.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.461 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 3.0 mp0 -46.28 -49.16 17.77 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -169.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.883 HG13 HD21 ' A' ' 55' ' ' LEU . 61.5 t -70.11 -46.81 71.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -167.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 12.7 p -66.47 -30.08 70.34 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.627 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 19.6 ttmt -61.27 -54.7 40.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.6 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.626 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 59.9 mm-40 -52.22 -52.29 53.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.081 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -58.8 -55.4 35.56 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.771 -176.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 85.6 mt -63.07 -44.15 96.58 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.991 -172.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.523 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -65.61 -49.04 70.18 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 123.143 0.277 . . . . 0.0 111.538 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.772 ' HD2' ' HA ' ' A' ' 1' ' ' GLN . 10.5 mtm180 -71.33 -35.89 71.37 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.714 -175.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -64.18 -44.09 93.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.487 0.66 . . . . 0.0 109.497 174.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.501 ' O ' HG12 ' A' ' 26' ' ' ILE . 66.7 t80 -54.81 -55.54 29.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.377 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -70.73 -27.63 64.1 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.972 -178.089 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.471 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 51.4 m -63.37 -52.87 59.88 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.744 176.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.691 HD23 HD21 ' A' ' 31' ' ' ASN . 3.1 mp -60.69 -36.59 79.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.484 0.183 . . . . 0.0 111.38 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.4 mm -67.63 -52.53 39.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.72 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -70.83 -35.01 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.664 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.588 ' HB2' HG13 ' A' ' 30' ' ' VAL . 64.2 mtp180 -75.06 -14.49 60.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.021 0.439 . . . . 0.0 111.242 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.66 40.12 85.89 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.526 -0.629 . . . . 0.0 111.526 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.673 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 3.4 p -127.42 56.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-O 122.519 1.152 . . . . 0.0 110.13 -173.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.691 HD21 HD23 ' A' ' 25' ' ' LEU . 12.8 t-20 -143.68 -163.64 1.7 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.583 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.486 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 94.1 m-85 60.73 30.14 19.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.512 0.673 . . . . 0.0 110.879 -176.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 32.7 m -153.15 112.84 3.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.745 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.2 mm? -61.85 -41.28 97.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.34 -172.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.48 -27.29 64.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.153 0.501 . . . . 0.0 110.389 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.0 m -73.88 -45.97 47.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.747 178.071 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' SER . 45.0 mt -61.32 -34.3 60.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -73.41 -25.52 60.57 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.375 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -85.6 -44.86 12.26 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.063 0.458 . . . . 0.0 110.263 176.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -65.89 -35.77 81.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.596 -176.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 70' ' ' LEU . 16.4 mt -55.96 -40.05 72.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.273 0.559 . . . . 0.0 109.645 172.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 51.4 mt -72.72 -38.39 58.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.397 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 t -75.25 -50.78 15.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.969 0.414 . . . . 0.0 110.73 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -62.83 -30.92 71.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.027 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 61' ' ' ALA . 15.6 m -68.07 -27.85 66.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -89.18 -15.18 34.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.218 0.532 . . . . 0.0 110.507 173.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.32 -22.2 41.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.534 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.764 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -76.94 -168.18 1.01 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.813 179.231 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -93.84 167.97 11.29 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.32 -46.53 35.53 Favored Glycine 0 CA--C 1.517 0.197 0 O-C-N 123.662 0.601 . . . . 0.0 114.442 -171.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -59.35 -38.79 81.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 117.146 0.473 . . . . 0.0 110.33 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.764 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.5 mt-10 -80.37 -36.49 33.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.204 -176.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -59.28 -47.79 84.04 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 174.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -68.13 -37.5 81.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.48 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.883 HD21 HG13 ' A' ' 13' ' ' VAL . 33.8 tp -52.72 -38.6 61.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.088 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 68.5 m -71.87 -15.04 62.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -73.19 -23.11 60.37 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.474 ' HB3' HG13 ' A' ' 97' ' ' ILE . 89.4 m-85 -85.33 -46.7 10.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.55 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.808 ' HA ' HD11 ' A' ' 97' ' ' ILE . 86.9 mt -62.21 -24.66 67.36 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.702 -178.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.76 7.11 61.72 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.626 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.43 ' HB2' ' SG ' ' A' ' 45' ' ' CYS . . . -90.49 59.85 4.43 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.451 0.643 . . . . 0.0 110.822 -178.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.3 t -166.11 146.93 6.57 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.449 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -87.2 24.42 1.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.527 0.68 . . . . 0.0 110.445 -176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -125.72 13.83 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.205 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -141.46 -176.0 4.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.721 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -73.89 88.78 1.84 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.965 0.412 . . . . 0.0 111.155 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -18.84 65.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.801 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -61.28 -21.72 64.2 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 66' ' ' ALA . 10.9 pt -85.44 -14.48 10.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.089 0.471 . . . . 0.0 110.48 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.761 HD12 HD12 ' A' ' 41' ' ' LEU . 21.8 tp -69.88 -15.42 63.07 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.876 -171.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.408 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 2.8 p -61.12 -29.66 69.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.535 174.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 58.6 mm-40 -63.47 -29.11 70.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.387 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.486 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.2 t -88.41 -56.79 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.192 0.52 . . . . 0.0 111.122 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.408 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 6.6 p -53.14 -47.83 68.39 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.283 -172.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.567 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.4 mpt_? -65.09 -51.78 52.91 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.726 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 45.9 Cg_exo -61.76 -34.96 81.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.549 1.499 . . . . 0.0 113.247 175.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 21.0 mmt -68.08 -13.55 62.29 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.2 t -67.7 -13.47 62.12 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -175.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.513 HG11 ' H ' ' A' ' 80' ' ' HIS . 2.8 p -134.77 -62.23 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.513 ' H ' HG11 ' A' ' 79' ' ' VAL . 12.7 t-80 -176.33 -89.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -173.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.726 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 49.5 mtp 68.11 167.56 0.12 Allowed Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 163.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.735 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 4.9 Cg_endo -44.92 4.02 0.01 OUTLIER 'Trans proline' 0 C--O 1.205 -1.151 1 C-N-CA 127.987 5.791 . . . . 0.0 117.969 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.621 ' HA ' HD11 ' A' ' 86' ' ' ILE . . . -34.6 -26.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -148.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.717 ' HE1' ' O ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -54.21 -42.98 70.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 120.471 1.487 . . . . 0.0 109.744 166.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.735 ' HB3' ' HB2' ' A' ' 82' ' ' PRO . 23.9 ttmm -71.1 -17.71 62.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.966 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.621 HD11 ' HA ' ' A' ' 83' ' ' ALA . 66.9 mt -64.84 -25.39 37.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.414 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.587 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 51.0 t -80.32 -30.58 38.15 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.59 173.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 50.8 mt-10 -65.53 -40.65 93.19 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 8.1 tppt? -57.96 -47.51 82.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.74 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.573 ' HB3' HD12 ' A' ' 97' ' ' ILE . 16.4 mt -65.67 -24.56 67.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.055 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.598 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 39.8 mtpt -69.99 -14.99 62.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.834 -177.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 34.9 pttt -73.94 -22.75 59.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.189 -0.605 . . . . 0.0 109.405 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -87.92 -45.88 9.87 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.913 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 10.5 t70 -142.46 138.02 30.72 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.689 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.2 m -87.02 -28.04 22.85 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -175.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -85.88 -14.23 45.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.114 0.483 . . . . 0.0 110.911 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.808 HD11 ' HA ' ' A' ' 59' ' ' LEU . 18.8 tt -55.02 -27.21 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.089 -175.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.43 ' HA ' ' HB3' ' A' ' 14' ' ' CYS . 15.8 p -85.39 -38.88 18.21 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -169.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.71 ' HG3' ' H ' ' A' ' 100' ' ' LEU . 6.5 pt-20 -79.58 -98.43 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.121 -170.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.71 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 94.5 mt 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 117.841 0.292 . . . . 0.0 110.326 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.466 ' HB3' ' N ' ' A' ' 105' ' ' THR . 34.7 mmtp -49.64 134.98 19.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.53 -174.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -61.86 -68.18 0.34 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.0 110.556 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -116.03 54.01 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.267 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER 68.44 2.93 3.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.199 -169.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.466 ' N ' ' HB3' ' A' ' 101' ' ' LYS . 15.2 t . . . . . 0 C--O 1.246 0.889 0 CA-C-N 114.997 -1.001 . . . . 0.0 108.374 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 120.057 -0.02 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 179.66 141.25 0.13 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 111.093 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -87.56 -70.76 0.6 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 167.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.37 -103.43 0.26 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 121.346 -0.454 . . . . 0.0 112.47 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.42 -22.92 69.87 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 111.766 -0.534 . . . . 0.0 111.766 175.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.429 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 59.4 mtm-85 -85.73 137.44 36.0 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-O 120.832 0.349 . . . . 0.0 110.062 175.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 36.6 Cg_endo -97.48 105.41 0.08 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 123.824 3.016 . . . . 0.0 111.317 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -90.32 -32.46 9.56 Favored Glycine 0 N--CA 1.436 -1.301 0 C-N-CA 119.111 -1.519 . . . . 0.0 111.733 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.734 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -166.21 -81.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.892 0.377 . . . . 0.0 110.232 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -176.48 -47.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.825 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.7 p -66.21 -90.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.357 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.641 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 31.2 tt0 -172.45 -81.68 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.885 HG11 HD23 ' A' ' 55' ' ' LEU . 36.4 t -56.86 -45.08 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 111.488 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.5 t -64.69 -35.42 80.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.852 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 13.3 ptpt -71.82 -37.73 70.28 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.108 0.48 . . . . 0.0 109.717 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.563 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 78.2 mm-40 -58.82 -51.31 70.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.335 178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.38 -55.63 26.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.572 -176.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 86.5 mt -59.79 -43.19 94.54 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.62 0.248 . . . . 0.0 111.506 -174.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.421 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 14.4 t-20 -74.76 -44.01 51.9 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.865 -176.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.563 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 7.0 tpp85 -55.2 -51.2 67.32 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.271 0.557 . . . . 0.0 110.158 175.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CD2' ' SD ' ' A' ' 77' ' ' MET . 29.6 t80 -59.57 -42.63 92.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.659 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.502 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -52.96 -57.01 11.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.513 178.7 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.678 ' HB2' ' HZ2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -76.18 -30.94 58.26 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.755 -173.662 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.5 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 4.8 t -68.34 -36.73 79.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.937 0.399 . . . . 0.0 110.288 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -67.21 -42.95 83.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.43 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.502 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -63.69 -43.31 98.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.085 175.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -55.86 -55.53 31.38 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.085 0.469 . . . . 0.0 110.777 177.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.4 mtm-85 -66.78 -17.35 64.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.163 -177.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.51 31.52 33.32 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.583 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.727 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -131.04 100.69 4.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.074 -175.109 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.409 ' CG ' ' H ' ' A' ' 32' ' ' PHE . 2.2 t-20 -168.8 -170.58 1.2 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.409 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 28.9 t80 73.9 -49.57 0.68 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.784 0.834 . . . . 0.0 111.545 176.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 3.9 m -66.95 114.99 6.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.942 0.401 . . . . 0.0 110.317 177.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.653 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -58.39 -45.15 88.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.983 -176.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -28.52 69.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.266 0.555 . . . . 0.0 110.431 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.501 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.3 m -79.78 -45.49 18.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.524 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' SER . 37.4 mt -60.11 -27.93 40.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -64.12 -41.53 97.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.773 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.478 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 18.8 mmmt -74.22 -45.52 47.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.686 0.755 . . . . 0.0 109.981 -179.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.92 -33.45 75.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.743 -1.117 . . . . 0.0 111.769 -174.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.456 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.2 tp -59.8 -29.24 68.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.548 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 81.4 mt -84.48 -50.5 14.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.297 175.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -55.42 -37.93 68.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.981 -178.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -71.63 -33.81 69.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.721 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.621 ' HA ' ' HG1' ' A' ' 48' ' ' THR . 26.6 p -85.41 -13.46 49.28 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 119.926 -0.709 . . . . 0.0 111.52 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.8 tp -86.58 -22.17 26.43 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 170.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -81.99 -23.22 36.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.041 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.779 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -79.89 -172.32 3.32 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.542 -175.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -99.23 173.85 6.59 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.853 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.14 -41.38 38.39 Favored Glycine 0 C--N 1.332 0.308 0 N-CA-C 114.993 0.757 . . . . 0.0 114.993 -169.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.9 tppt? -60.81 -43.54 98.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 0.0 109.955 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.779 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 19.1 mt-10 -80.45 -32.5 37.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.58 -174.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.63 -52.49 64.15 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -63.28 -35.63 81.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.486 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.885 HD23 HG11 ' A' ' 13' ' ' VAL . 52.1 tp -56.52 -33.57 66.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.029 177.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.803 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 51.3 t -70.67 -25.32 62.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.378 -177.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.52 ' CZ ' HG22 ' A' ' 62' ' ' THR . 64.3 m-85 -69.05 -28.14 66.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.207 0.527 . . . . 0.0 109.708 174.499 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.505 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.1 m-85 -86.83 -34.27 19.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.926 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.3 mt -71.51 -14.87 62.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.826 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.565 ' HA3' HD11 ' A' ' 69' ' ' ILE . . . 91.22 11.85 60.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.899 -0.667 . . . . 0.0 113.744 171.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.803 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -84.02 -43.29 15.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.006 0.403 . . . . 0.0 111.107 -178.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.52 HG22 ' CZ ' ' A' ' 57' ' ' TYR . 1.2 m -64.65 154.41 36.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -178.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.488 ' HZ3' ' HB3' ' A' ' 63' ' ' LYS . 8.6 mtpm? -80.3 49.18 1.09 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.901 0.381 . . . . 0.0 111.659 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.86 46.01 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' CB ' ' HA2' ' A' ' 60' ' ' GLY . . . -148.79 -167.77 2.92 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.169 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.9 123.17 21.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -76.34 -29.82 57.39 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -84.85 -29.75 25.05 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.565 HD11 ' HA3' ' A' ' 60' ' ' GLY . 24.2 pt -68.17 -16.89 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 120.758 0.313 . . . . 0.0 111.287 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.409 HD21 ' O ' ' A' ' 70' ' ' LEU . 3.0 tt -63.23 -37.98 89.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.9 m -68.39 -24.59 64.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.667 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.07 -24.93 65.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.009 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.506 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 59.0 t -87.57 -57.71 4.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 0.0 110.937 175.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.405 HG21 ' CG2' ' A' ' 37' ' ' ILE . 12.4 p -54.61 -54.97 34.48 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -173.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.653 ' HA ' HD11 ' A' ' 34' ' ' LEU . 9.3 mpt_? -54.4 -50.9 82.45 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 123.234 0.334 . . . . 0.0 111.867 -174.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.506 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 32.3 Cg_exo -64.96 -45.39 8.11 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 121.33 1.353 . . . . 0.0 112.707 173.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.429 ' SD ' ' CD2' ' A' ' 21' ' ' PHE . 53.5 ttm -65.25 -13.19 57.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.79 0.329 . . . . 0.0 111.812 -175.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.1 m -58.66 -19.25 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.726 175.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 10.7 p -141.53 167.65 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 174.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -70.05 110.02 4.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.883 -0.51 . . . . 0.0 110.15 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.732 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 21.9 mmm -130.31 172.94 6.42 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -167.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.732 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.7 Cg_exo -39.19 1.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.824 1 C-N-CA 127.89 5.727 . . . . 0.0 118.68 171.032 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.57 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -39.83 -26.09 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -168.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.734 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.17 -41.3 79.0 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 122.129 0.966 . . . . 0.0 109.269 172.045 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.539 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 29.5 mtpt -85.26 -22.55 28.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.078 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.57 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 58.8 mt -66.93 -33.26 62.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 C-N-CA 120.399 -0.521 . . . . 0.0 109.878 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.486 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 34.6 t -62.63 -31.97 72.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.187 0.518 . . . . 0.0 110.299 173.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.617 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 33.8 tt0 -68.5 -34.82 76.56 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.684 177.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.213 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.28 -42.53 30.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.416 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.617 ' HG3' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -69.75 -13.77 62.45 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.819 0.342 . . . . 0.0 110.642 179.822 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -59.72 -37.75 79.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.157 0.503 . . . . 0.0 109.744 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.0 -46.52 18.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.815 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.576 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 15.2 t70 -142.34 108.16 5.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.939 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.589 ' HA ' ' HB2' ' A' ' 91' ' ' LYS . 13.0 t -73.48 -17.0 61.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.209 -175.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 23.8 mt-30 -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.64 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.505 HG12 ' HB3' ' A' ' 58' ' ' TYR . 84.0 mt -56.79 -48.84 80.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.575 0.702 . . . . 0.0 110.26 173.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.49 -48.87 13.15 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.814 -177.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -87.58 37.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.039 -176.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.641 HD21 HG12 ' A' ' 13' ' ' VAL . 21.3 tp -74.05 -57.18 4.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 65.13 122.45 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.207 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.462 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 96.6 m-85 -61.3 -60.36 3.86 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.269 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 47.3 mm-40 -101.13 -70.09 0.75 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 2.6 tppp? 172.77 127.43 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.597 177.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.749 -0.644 . . . . 0.0 109.873 177.127 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.663 ' HA ' ' HB3' ' A' ' 23' ' ' LYS . 5.7 tp-100 . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.457 0.17 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.475 ' OE2' ' HG2' ' A' ' 23' ' ' LYS . 2.0 mp0 -52.46 96.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 168.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.14 66.98 0.64 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.49 -108.91 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.199 -0.761 . . . . 0.0 111.199 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -121.54 62.27 0.52 Allowed Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.161 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' NH1' ' HG3' ' A' ' 2' ' ' GLU . 18.2 tpp180 56.12 78.71 0.37 Allowed Pre-proline 0 CA--C 1.534 0.353 0 CA-C-O 121.311 0.576 . . . . 0.0 111.458 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.91 58.28 4.42 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.111 2.541 . . . . 0.0 110.621 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.873 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -77.82 -34.72 37.76 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.283 -175.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -169.12 -92.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.931 0.396 . . . . 0.0 111.165 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -155.19 -47.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.259 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -76.12 -107.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.432 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 5.1 tp10 -153.84 -72.97 0.13 Allowed 'General case' 0 C--O 1.219 -0.5 0 O-C-N 122.105 -0.372 . . . . 0.0 111.457 -175.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.679 HG13 HD12 ' A' ' 55' ' ' LEU . 77.7 t -57.75 -55.27 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.563 ' HA ' ' CD1' ' A' ' 55' ' ' LEU . 35.4 t -59.53 -35.44 74.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.479 0.657 . . . . 0.0 110.441 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.529 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 6.3 ttmt -67.7 -46.52 72.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.755 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.571 ' HB3' HH21 ' A' ' 20' ' ' ARG . 26.0 mm-40 -57.41 -53.79 54.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.961 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -56.98 -55.37 35.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.246 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.559 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 69.8 mt -61.44 -55.35 32.29 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 120.533 0.206 . . . . 0.0 111.46 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.873 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 26.3 t-20 -66.47 -45.53 79.41 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.571 HH21 ' HB3' ' A' ' 16' ' ' GLU . 18.6 ttp85 -67.3 -39.04 85.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.438 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -61.33 -46.15 91.47 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 122.308 1.052 . . . . 0.0 109.192 174.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.742 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.2 t80 -55.76 -38.08 69.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 112.864 -1.971 . . . . 0.0 111.974 -175.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.663 ' HB3' ' HA ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -85.46 -28.98 24.67 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.476 178.023 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.591 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 69.0 m -59.9 -40.26 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.886 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.7 mp -69.66 -25.02 63.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.375 179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.0 mm -78.76 -51.61 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.97 -46.4 89.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.177 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.453 ' HB2' HG12 ' A' ' 30' ' ' VAL . 53.2 mtp85 -72.92 -13.64 61.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.009 -177.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.75 45.08 54.65 Favored Glycine 0 C--N 1.332 0.344 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.702 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 6.0 p -138.26 51.21 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 0 CA-C-O 122.378 1.085 . . . . 0.0 109.883 -170.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -130.82 179.96 5.66 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.593 -0.692 . . . . 0.0 111.345 -172.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.578 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 71.0 m-85 72.28 -48.14 0.68 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.978 0.911 . . . . 0.0 112.131 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.473 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 15.0 m -64.43 104.85 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.44 -41.34 72.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.854 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -63.32 -34.15 77.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.597 0.713 . . . . 0.0 110.197 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.473 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 85.9 m -79.71 -43.94 21.73 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.259 -178.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 33' ' ' SER . 67.5 mt -59.34 -31.74 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.464 ' HG3' HD23 ' A' ' 70' ' ' LEU . 35.2 tt0 -61.37 -55.13 34.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.812 175.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HA ' HD13 ' A' ' 42' ' ' ILE . 21.9 tptm -67.13 -35.28 79.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.212 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.06 -34.59 73.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.196 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.01 -41.65 96.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 172.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 39' ' ' LYS . 99.0 mt -59.57 -48.67 86.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.735 175.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 t -63.76 -48.71 75.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.891 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.543 ' HZ ' ' HG2' ' A' ' 20' ' ' ARG . 11.3 t80 -63.95 -34.57 78.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.28 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.469 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -60.44 -33.25 72.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.632 176.868 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -86.87 -39.39 15.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.44 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.18 -15.66 60.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.931 -173.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.739 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.97 -171.17 0.83 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.865 0.364 . . . . 0.0 111.466 178.849 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.24 164.34 13.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -47.61 -41.47 18.73 Favored Glycine 0 C--N 1.331 0.253 0 O-C-N 123.661 0.601 . . . . 0.0 114.1 -171.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.718 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -61.05 -43.22 99.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.222 0.534 . . . . 0.0 110.569 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.739 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 21.0 mt-10 -79.04 -30.42 44.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.171 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -63.57 -18.89 64.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 40.6 mmt180 -86.61 -46.27 10.25 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.858 172.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.679 HD12 HG13 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -62.46 -25.13 67.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.775 -174.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.635 ' N ' HD22 ' A' ' 55' ' ' LEU . 25.7 p -72.66 -14.75 61.65 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.255 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.494 ' HA ' ' OG1' ' A' ' 62' ' ' THR . 66.9 m-85 -72.72 -33.72 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.173 0.511 . . . . 0.0 109.626 171.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -85.58 -29.24 24.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.552 HD11 ' HG ' ' A' ' 55' ' ' LEU . 8.1 mp -80.23 -6.04 57.18 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.852 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.522 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 84.43 -0.8 89.24 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.233 176.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.442 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -80.07 42.54 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.148 0.499 . . . . 0.0 111.465 -177.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.494 ' OG1' ' HA ' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -145.17 133.3 21.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.899 -179.232 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.25 -7.7 52.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.74 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -90.5 -18.51 25.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.262 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.71 -160.75 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.377 -175.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.67 132.56 35.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.105 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 p -85.32 -18.09 34.88 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -77.96 -24.07 48.28 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.439 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.522 HG23 ' HA3' ' A' ' 60' ' ' GLY . 17.3 tt -85.09 -23.84 7.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.309 0.576 . . . . 0.0 109.653 173.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.464 HD23 ' HG3' ' A' ' 38' ' ' GLU . 41.1 tp -63.06 -42.7 99.75 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.094 175.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 p -69.17 -15.42 63.4 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.877 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.517 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 53.8 mm-40 -77.82 -56.67 4.31 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.672 177.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.45 -34.02 67.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-O 120.973 0.416 . . . . 0.0 111.748 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.407 HG21 HG21 ' A' ' 37' ' ' ILE . 7.6 p -57.33 -27.52 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -74.17 -54.49 3.36 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.861 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.517 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 23.9 Cg_endo -64.74 -17.73 60.4 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.653 1.569 . . . . 0.0 113.195 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.5 mmt -75.69 -16.53 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.473 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.578 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 34.1 t -86.19 -52.77 5.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.861 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.546 HG11 ' HG3' ' A' ' 81' ' ' MET . 7.3 p -109.06 142.34 21.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.011 -176.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.742 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 72.5 m80 -57.15 111.37 1.04 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.844 0.354 . . . . 0.0 110.593 -177.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.546 ' HG3' HG11 ' A' ' 79' ' ' VAL . 32.1 mtp -140.8 170.08 10.24 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -168.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.433 ' C ' HG13 ' A' ' 86' ' ' ILE . 30.1 Cg_exo -41.0 0.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.828 1 C-N-CA 127.623 5.549 . . . . 0.0 118.093 171.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.433 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -38.17 -38.61 0.35 Allowed 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 120.195 1.361 . . . . 0.0 114.522 -169.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.596 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.4 OUTLIER -60.64 -38.17 83.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.891 -0.506 . . . . 0.0 110.766 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 84' ' ' MET . 51.6 mttm -86.25 -22.97 26.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.221 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.433 HG13 ' C ' ' A' ' 82' ' ' PRO . 25.8 mt -62.17 -33.1 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.161 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.559 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 41.8 t -63.86 -36.1 82.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.167 0.508 . . . . 0.0 110.604 174.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.7 mt-10 -66.81 -39.14 87.6 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.703 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -62.38 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.678 175.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.422 ' HA ' HD11 ' A' ' 93' ' ' LEU . 14.6 mt -60.28 -31.59 70.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.595 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.591 ' HB3' ' HZ1' ' A' ' 91' ' ' LYS . 9.5 mtpm? -65.2 -19.31 65.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.25 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.579 ' HZ3' ' HB2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER -77.54 -23.93 50.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 109.789 176.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.422 HD11 ' HA ' ' A' ' 90' ' ' LEU . 6.7 mp -84.39 -52.84 5.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.745 175.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -144.16 132.48 21.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.982 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -85.1 -18.45 34.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -174.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.689 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 78.7 mt-30 -67.61 -33.18 74.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.569 0.223 . . . . 0.0 110.644 -178.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 63.5 mt -46.31 -48.96 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.14 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -34.93 15.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.685 -177.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.652 ' HA ' ' HE3' ' A' ' 101' ' ' LYS . 16.3 mm-40 -89.55 21.15 3.55 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -171.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.718 ' HB3' ' HG3' ' A' ' 51' ' ' LYS . 34.0 mt -67.72 -54.22 21.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.443 173.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.652 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 30.0 mmtp 70.18 139.71 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.753 0.787 . . . . 0.0 112.47 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.93 83.13 2.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 59.28 99.93 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 O-C-N 123.934 0.771 . . . . 0.0 111.419 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -79.3 36.42 0.3 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.666 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.438 -179.975 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 61.47 72.52 0.51 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.591 0.71 . . . . 0.0 109.626 -178.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.27 113.32 17.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.701 -173.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 66.15 32.38 82.12 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.37 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.542 ' O ' ' HD2' ' A' ' 6' ' ' ARG . . . 87.2 -131.13 10.4 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.24 -176.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.577 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 14.9 mmm180 -124.7 59.05 19.42 Favored Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 117.001 0.4 . . . . 0.0 111.47 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.531 ' HD3' ' C ' ' A' ' 5' ' ' GLY . 93.9 Cg_endo -103.14 47.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 123.259 2.639 . . . . 0.0 111.654 -179.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.638 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -77.46 -27.43 59.4 Favored Glycine 0 CA--C 1.507 -0.433 0 C-N-CA 119.316 -1.421 . . . . 0.0 112.088 -171.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 1.01 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -171.29 -97.77 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.756 0.312 . . . . 0.0 110.881 177.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -161.75 176.91 10.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 82.9 m 60.62 -85.57 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 123.213 0.605 . . . . 0.0 111.129 -175.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.792 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 37.0 tt0 -179.61 -76.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.869 HG11 HD21 ' A' ' 55' ' ' LEU . 90.6 t -60.4 -39.58 81.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -167.177 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.589 ' SG ' ' HA ' ' A' ' 98' ' ' CYS . 5.7 p -70.98 -32.21 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.049 178.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.792 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.8 ptmt -73.81 -31.14 63.11 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -177.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.33 -51.81 64.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.147 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.402 ' CE2' ' HD2' ' A' ' 44' ' ' PHE . 44.0 t80 -60.53 -53.19 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.041 -179.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 9' ' ' ALA . 84.7 mt -58.82 -47.61 84.21 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.126 0.266 . . . . 0.0 111.549 -174.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.501 ' HB2' ' CA ' ' A' ' 8' ' ' GLY . 29.0 t-20 -60.2 -49.46 77.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.716 0.293 . . . . 0.0 111.181 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -61.12 -46.06 92.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.275 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -65.83 -47.65 74.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.172 0.511 . . . . 0.0 110.601 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.459 ' O ' HG12 ' A' ' 26' ' ' ILE . 64.1 t80 -51.33 -50.27 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.713 -178.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.827 ' HB2' ' HZ3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -78.52 -33.11 48.2 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.543 -176.583 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.502 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 8.4 t -62.68 -36.02 81.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 0.0 110.786 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.794 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.8 mp -72.91 -27.53 61.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.929 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -76.2 -32.97 23.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.51 -57.13 10.06 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.529 0.68 . . . . 0.0 110.502 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -75.23 -21.43 58.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.486 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.97 45.91 90.9 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.422 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.794 HG22 ' HG ' ' A' ' 25' ' ' LEU . 2.8 m -96.93 4.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.541 0.686 . . . . 0.0 111.461 -173.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' A' ' 33' ' ' SER . 20.9 m120 -82.56 -171.32 3.42 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.972 -170.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 92.7 m-85 71.76 -34.9 0.31 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.502 0.721 . . . . 0.0 111.252 -176.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 16.6 m -88.09 103.02 15.35 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.09 -38.99 80.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.243 -176.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.4 -38.07 85.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.067 0.461 . . . . 0.0 110.674 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 23.0 m -73.7 -46.14 47.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.757 -178.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 33' ' ' SER . 48.1 mt -59.97 -31.63 48.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.476 0.655 . . . . 0.0 109.281 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -70.09 -43.67 70.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.652 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' C ' ' HD3' ' A' ' 39' ' ' LYS . 12.7 tmtt? -66.92 -42.06 86.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.076 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.516 ' HG3' HG23 ' A' ' 30' ' ' VAL . 55.3 mm-40 -67.72 -33.51 75.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.486 -179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.583 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 13.1 mt -54.0 -51.75 62.95 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 170.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.69 -49.78 81.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -58.83 -48.76 80.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.504 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.402 ' HD2' ' CE2' ' A' ' 17' ' ' PHE . 14.7 t80 -67.33 -31.37 71.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.881 0.372 . . . . 0.0 110.187 -175.209 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 62.8 m -64.68 -37.91 89.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.64 177.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.419 ' O ' HD12 ' A' ' 46' ' ' LEU . 2.0 tm? -86.06 -36.46 19.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.131 0.491 . . . . 0.0 110.512 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.33 -22.16 66.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.0 -175.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.744 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -76.76 -169.44 1.27 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.635 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -97.82 175.74 6.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.645 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.91 -40.94 35.74 Favored Glycine 0 CA--C 1.518 0.276 0 O-C-N 123.621 0.576 . . . . 0.0 114.463 -170.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.636 ' HZ1' ' HB2' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -62.2 -50.85 70.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.07 0.435 . . . . 0.0 110.484 -179.648 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.744 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 1.6 mp0 -71.75 -34.23 69.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.621 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -57.44 -45.6 84.5 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -71.61 -37.61 70.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.39 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.869 HD21 HG11 ' A' ' 13' ' ' VAL . 22.9 tp -53.75 -32.59 52.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.555 178.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.634 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 32.6 t -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -176.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.49 -29.76 62.7 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.572 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.444 ' HB3' HG13 ' A' ' 97' ' ' ILE . 87.7 m-85 -74.68 -44.59 49.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.406 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.687 HD21 HD11 ' A' ' 97' ' ' ILE . 77.6 mt -67.28 -27.77 67.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.012 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.401 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 91.56 -9.65 76.61 Favored Glycine 0 C--O 1.225 -0.462 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.756 172.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.634 ' HB1' ' SG ' ' A' ' 56' ' ' CYS . . . -67.14 -16.16 64.15 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.159 0.48 . . . . 0.0 112.264 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -72.04 138.72 48.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -74.52 47.34 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.24 0.543 . . . . 0.0 111.552 -176.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -132.4 -32.3 1.35 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.516 178.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.12 -161.23 0.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.622 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.484 ' O ' HG21 ' A' ' 69' ' ' ILE . . . -63.32 140.17 58.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 174.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.477 ' HA ' HD11 ' A' ' 70' ' ' LEU . 33.3 p -85.74 -24.49 26.88 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -69.13 -30.05 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.39 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.484 HG21 ' O ' ' A' ' 66' ' ' ALA . 19.5 tt -66.71 -22.6 29.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.779 0.323 . . . . 0.0 110.654 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.477 HD11 ' HA ' ' A' ' 67' ' ' THR . 10.3 mp -61.02 -53.26 59.45 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.635 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 4.4 p -65.92 -34.02 77.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.544 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -58.65 -31.15 67.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.646 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.28 -46.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.991 0.424 . . . . 0.0 110.649 175.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.635 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 46.5 p -59.47 -36.04 75.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.456 ' CZ ' ' HB2' ' A' ' 71' ' ' SER . 1.5 mpp_? -58.93 -55.81 42.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.214 -178.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.61 -39.75 20.11 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.266 1.311 . . . . 0.0 112.421 175.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.1 mmt -60.27 -19.5 55.08 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.3 t -62.3 -14.97 44.74 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.578 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -151.47 175.75 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -176.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.578 ' H ' HG22 ' A' ' 79' ' ' VAL . 12.8 m-70 -64.43 122.44 16.75 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.575 ' HE1' ' HD2' ' A' ' 82' ' ' PRO . 43.0 mmm -140.71 167.9 16.18 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -170.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.575 ' HD2' ' HE1' ' A' ' 81' ' ' MET . 76.3 Cg_exo -46.46 0.4 0.02 OUTLIER 'Trans proline' 0 C--O 1.208 -1.016 1 C-N-CA 126.966 5.11 . . . . 0.0 117.3 176.09 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.51 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -35.9 -40.18 0.18 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 -156.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 1.01 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.21 -36.17 68.13 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.672 0.669 . . . . 0.0 110.826 174.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 19.1 mtpp -85.12 -20.43 30.33 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.369 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.51 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 32.7 mt -64.42 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.516 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.681 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 51.6 t -66.42 -22.2 66.22 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.743 177.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.2 mt-10 -75.74 -37.98 58.88 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.592 175.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.59 -30.82 71.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.031 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 93.4 mt -70.09 -14.97 62.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.247 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.575 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 30.7 mtpp -67.81 -17.55 64.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.701 0.286 . . . . 0.0 110.645 178.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.728 ' HE3' ' HA ' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -69.51 -28.14 65.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 0.0 109.896 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.417 ' N ' HD13 ' A' ' 93' ' ' LEU . 6.0 mp -88.58 -48.7 7.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.575 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 8.8 t70 -146.44 126.23 13.5 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.9 m -78.21 -26.21 47.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.68 0.276 . . . . 0.0 111.517 -174.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.4 -12.57 51.75 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.598 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.687 HD11 HD21 ' A' ' 59' ' ' LEU . 17.7 tt -48.35 -34.05 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.589 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 30.5 p -82.36 -28.45 31.54 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.102 -176.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -79.18 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.422 -171.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 8.5 mp 64.48 -62.07 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.365 0.666 . . . . 0.0 111.475 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 100' ' ' LEU . 69.8 mmtt 69.47 129.0 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.39 0.676 . . . . 0.0 111.141 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.448 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 80.4 m-85 -69.1 -167.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.049 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -67.53 -19.72 65.33 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.234 -0.291 . . . . 0.0 111.0 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.439 ' C ' ' HG1' ' A' ' 105' ' ' THR . 1.4 tppp? 73.15 0.41 3.67 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 123.809 0.693 . . . . 0.0 109.975 178.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.439 ' HG1' ' C ' ' A' ' 104' ' ' LYS . 44.8 m . . . . . 0 C--O 1.247 0.956 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.884 -166.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.416 ' HA ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.543 ' HA ' ' OD1' ' A' ' 19' ' ' ASN . 44.2 mt-10 60.09 -169.68 0.15 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.349 0.406 . . . . 0.0 111.412 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.439 ' HB1' ' CG ' ' A' ' 7' ' ' PRO . . . 178.74 87.58 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.688 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.27 -83.8 1.08 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.588 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -127.81 36.85 2.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.852 -0.69 . . . . 0.0 112.167 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 54.23 83.44 0.23 Allowed Pre-proline 0 N--CA 1.466 0.345 0 CA-C-O 121.264 0.554 . . . . 0.0 111.305 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.439 ' CG ' ' HB1' ' A' ' 3' ' ' ALA . 2.5 Cg_endo -83.87 56.81 5.28 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.39 2.727 . . . . 0.0 111.102 -173.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.669 ' HA3' ' HA ' ' A' ' 15' ' ' LYS . . . -71.92 -23.96 77.26 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.587 -0.816 . . . . 0.0 111.801 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.599 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -167.34 -93.95 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 120.714 0.292 . . . . 0.0 111.565 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -164.16 -32.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.793 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.84 -90.09 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.232 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.562 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 43.3 tt0 -170.81 -76.73 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.72 HG11 HD23 ' A' ' 55' ' ' LEU . 26.4 t -60.32 -46.13 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 111.11 -173.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.587 ' HA ' HD21 ' A' ' 55' ' ' LEU . 45.6 t -63.98 -28.89 70.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.374 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.669 ' HA ' ' HA3' ' A' ' 8' ' ' GLY . 55.1 mtpt -65.1 -50.46 66.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.596 0.712 . . . . 0.0 109.608 174.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.5 mm-40 -54.51 -55.15 32.08 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.371 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.411 ' HB2' HD22 ' A' ' 55' ' ' LEU . 24.4 t80 -58.28 -55.67 31.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.637 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.474 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 92.4 mt -61.98 -48.05 82.1 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -173.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.543 ' OD1' ' HA ' ' A' ' 2' ' ' GLU . 4.3 t-20 -69.6 -42.85 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.258 0.551 . . . . 0.0 110.686 -176.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -70.74 -36.84 73.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.203 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -59.36 -45.86 90.25 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -52.68 -56.79 12.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.451 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -69.69 -25.12 63.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.791 -175.499 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.579 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 74.4 m -67.76 -56.02 10.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.864 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.66 HD13 HG21 ' A' ' 30' ' ' VAL . 3.9 mm? -61.01 -39.02 88.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.275 -177.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 22' ' ' TYR . 47.4 mm -65.83 -37.29 79.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.867 0.365 . . . . 0.0 110.81 177.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.84 -45.0 65.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.759 ' HG3' HG13 ' A' ' 30' ' ' VAL . 2.8 ptm180 -74.69 -13.6 60.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.905 0.383 . . . . 0.0 111.34 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.52 32.89 14.68 Favored Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.403 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.759 HG13 ' HG3' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -142.37 112.54 2.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -178.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.779 ' HA ' HD11 ' A' ' 37' ' ' ILE . 0.2 OUTLIER -169.12 15.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -179.282 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -125.06 13.68 8.41 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 -174.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.63 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 49.4 m -122.32 124.47 43.8 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.618 HD12 ' HA ' ' A' ' 75' ' ' ARG . 3.6 mm? -68.91 -38.62 79.69 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.45 -15.64 60.41 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.414 0.626 . . . . 0.0 109.79 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.63 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 37.8 m -84.06 -48.2 10.15 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.943 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.779 HD11 ' HA ' ' A' ' 31' ' ' ASN . 33.7 mm -59.44 -29.74 42.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.51 -43.31 93.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.782 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.473 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 14.5 mmmm -83.71 -34.62 24.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.121 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.482 ' HB3' HD11 ' A' ' 25' ' ' LEU . 11.2 mm-40 -66.39 -33.88 76.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.3 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.76 -34.09 72.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.114 0.483 . . . . 0.0 109.845 171.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.616 HG12 ' HA ' ' A' ' 62' ' ' THR . 80.9 mt -73.11 -51.6 25.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.232 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.9 t -58.78 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.755 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -65.57 -35.57 81.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.017 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 25.9 t -65.07 -33.34 75.8 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.87 177.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.6 tp -87.07 -15.93 37.09 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.187 0.518 . . . . 0.0 111.05 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -90.48 -14.96 31.71 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.937 -175.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.77 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -92.37 -169.91 2.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.548 -173.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -94.82 173.62 7.51 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.875 177.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.44 -49.17 33.13 Favored Glycine 0 C--N 1.33 0.242 0 O-C-N 123.821 0.701 . . . . 0.0 114.651 -168.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.766 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 12.6 mptt -61.98 -41.29 97.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.216 0.508 . . . . 0.0 111.127 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.77 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 13.8 mm-40 -68.58 -40.47 80.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.195 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -59.28 -36.52 75.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.48 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -77.62 -37.85 49.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.647 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.72 HD23 HG11 ' A' ' 13' ' ' VAL . 53.3 tp -63.48 -29.5 70.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.154 -174.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 13.4 p -63.59 -27.33 69.17 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.771 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.71 -30.65 71.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 0.0 110.186 175.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.513 ' HB3' HG12 ' A' ' 97' ' ' ILE . 85.1 m-85 -86.48 -22.59 26.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.683 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' O ' HG22 ' A' ' 73' ' ' VAL . 87.3 mt -106.19 29.63 6.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.861 0.362 . . . . 0.0 111.772 -175.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.564 ' O ' ' HG ' ' A' ' 70' ' ' LEU . . . 63.15 62.97 4.92 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 113.504 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.6 177.62 7.68 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.616 ' HA ' HG12 ' A' ' 42' ' ' ILE . 42.9 p 62.9 148.12 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.492 1.117 . . . . 0.0 112.31 -179.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -84.68 56.43 3.86 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.624 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -163.19 -35.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.165 -175.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.78 -170.42 2.98 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.29 101.85 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.882 0.739 . . . . 0.0 111.056 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -15.42 41.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.262 -169.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -79.35 -46.38 17.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.8 pt -69.8 -14.27 18.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.613 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.2 tt -55.64 -42.8 75.51 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.766 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.593 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 10.8 p -74.23 -28.16 61.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.92 -22.75 62.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.443 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 59' ' ' LEU . 61.7 t -88.07 -55.31 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.044 172.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.467 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 10.6 p -56.06 -43.45 77.92 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.618 ' HA ' HD12 ' A' ' 34' ' ' LEU . 11.5 mpt_? -62.36 -53.02 61.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.35 -177.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.431 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 53.2 Cg_exo -57.94 -38.81 90.79 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.742 1.628 . . . . 0.0 112.803 172.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.5 mmt -58.75 -25.12 62.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.637 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.2 t -63.12 -14.03 43.63 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.607 HG23 ' H ' ' A' ' 80' ' ' HIS . 9.7 p -149.79 175.01 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.607 ' H ' HG23 ' A' ' 79' ' ' VAL . 28.1 m80 -72.62 109.04 5.98 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.764 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 23.7 mmm -125.56 166.9 18.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 121.936 0.874 . . . . 0.0 113.179 -170.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.764 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.1 Cg_exo -39.89 2.95 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.951 1 C-N-CA 128.211 5.94 . . . . 0.0 118.339 169.525 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.499 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -39.17 -32.78 0.11 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -164.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.599 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.3 OUTLIER -61.87 -35.32 77.95 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.388 0.995 . . . . 0.0 110.397 176.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 16.1 ptpt -86.43 -19.59 29.41 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 1.001 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 37.7 mt -61.63 -41.72 91.4 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.327 -179.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.508 ' HB3' ' CB ' ' A' ' 9' ' ' ALA . 49.1 t -70.36 -22.32 62.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.322 0.582 . . . . 0.0 110.641 176.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.55 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 17.4 mm-40 -70.13 -26.25 63.86 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 1.001 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 8.5 mtmp? -81.53 -28.99 33.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.494 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.557 ' HA ' HD11 ' A' ' 93' ' ' LEU . 2.8 mm? -63.57 -29.2 70.49 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.474 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 45.2 mttp -55.24 -26.76 41.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.06 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -75.5 -15.55 60.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 90' ' ' LEU . 6.5 mp -91.2 -52.98 4.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.452 176.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.578 ' HB3' HG13 ' A' ' 97' ' ' ILE . 25.6 t70 -158.65 138.7 12.19 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.834 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 43.0 m -85.22 -24.63 27.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.191 -176.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.425 ' HB3' ' OD2' ' A' ' 94' ' ' ASP . 8.1 tt0 -70.37 -22.23 62.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.299 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.578 HG13 ' HB3' ' A' ' 94' ' ' ASP . 36.3 mt -52.69 -45.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.717 0.77 . . . . 0.0 109.733 172.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 -47.27 9.09 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.972 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.22 42.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.461 HD21 HG12 ' A' ' 13' ' ' VAL . 18.4 tp -70.35 -53.91 14.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.836 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 104' ' ' LYS . 72.6 mmtt 69.4 121.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.602 0.715 . . . . 0.0 112.003 176.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.766 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.4 m-85 -67.07 -68.26 0.39 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.023 178.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -116.63 22.03 13.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.036 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.459 ' HA ' ' HB3' ' A' ' 101' ' ' LYS . 61.8 mmtt 66.7 6.94 4.82 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.105 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 8.8 m . . . . . 0 N--CA 1.439 -1.009 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.95 -166.006 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.477 ' NE2' ' HA ' ' A' ' 24' ' ' SER . 20.2 mt-30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.976 0.417 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.498 ' HG2' ' CZ ' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -90.63 -175.15 4.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.293 172.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.54 56.32 1.72 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.811 0.339 . . . . 0.0 111.257 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.7 -99.9 1.91 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.432 172.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -81.75 12.14 43.11 Favored Glycine 0 N--CA 1.455 -0.094 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.789 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.587 ' HB3' ' HG3' ' A' ' 15' ' ' LYS . 12.2 mpt_? 55.62 72.84 0.95 Allowed Pre-proline 0 C--N 1.331 -0.229 0 C-N-CA 122.873 0.469 . . . . 0.0 112.231 178.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . 13.9 Cg_exo -70.16 52.62 1.14 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.562 2.175 . . . . 0.0 111.622 172.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.717 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -98.62 -30.14 7.01 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.576 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . 164.38 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 123.907 0.883 . . . . 0.0 109.855 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -110.86 -19.05 12.95 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.966 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 62.3 m -71.28 -0.99 11.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.902 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.857 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 36.5 tt0 72.85 -65.84 0.34 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 114.892 -1.049 . . . . 0.0 113.626 166.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.888 HG13 HD23 ' A' ' 55' ' ' LEU . 57.6 t -62.61 -42.67 96.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.031 -176.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.67 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 29.9 p -74.74 -18.56 60.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.384 175.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.857 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 9.6 ptmt -72.1 -38.16 69.4 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.752 ' HB2' ' HH ' ' A' ' 102' ' ' TYR . 73.3 mm-40 -67.74 -51.82 44.79 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.561 175.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -58.09 -54.94 41.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.552 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.505 HD22 ' HE3' ' A' ' 77' ' ' MET . 91.9 mt -65.83 -32.75 74.45 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 121.33 -0.148 . . . . 0.0 111.208 -175.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.561 ' OD1' ' HA ' ' A' ' 6' ' ' ARG . 3.0 t-20 -71.58 -53.95 12.05 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.069 -0.253 . . . . 0.0 110.909 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.491 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 68.9 mtp180 -53.16 -51.0 63.42 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.047 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.77 -50.61 72.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.789 -179.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.638 ' O ' HG12 ' A' ' 26' ' ' ILE . 26.3 t80 -54.45 -55.63 26.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.867 -178.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -69.9 -38.28 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -175.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.477 ' HA ' ' NE2' ' A' ' 1' ' ' GLN . 46.7 t -64.31 -27.87 69.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 0.0 110.46 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.811 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 1.4 tp -82.08 -36.31 27.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.31 -176.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.638 HG12 ' O ' ' A' ' 22' ' ' TYR . 44.6 mm -65.41 -49.1 80.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.141 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.406 ' HB3' HE22 ' A' ' 1' ' ' GLN . 24.8 t70 -66.0 -42.05 90.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.673 -176.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.524 ' HB2' HG11 ' A' ' 30' ' ' VAL . 81.5 mtm180 -77.34 -12.52 59.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.813 0.34 . . . . 0.0 111.729 -177.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.48 39.61 56.21 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.559 HG13 ' HA ' ' A' ' 25' ' ' LEU . 2.2 p -126.09 27.73 2.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 122.921 1.343 . . . . 0.0 109.444 -170.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.811 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 3.6 t-20 -131.92 99.84 4.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.216 -174.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 3.7 t80 166.13 -28.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.627 1.205 . . . . 0.0 108.507 174.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -82.57 120.85 26.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.219 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.618 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -59.29 -38.58 80.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.619 -175.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.52 -25.67 50.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.005 0.431 . . . . 0.0 110.618 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.481 HG22 HG23 ' A' ' 30' ' ' VAL . 29.7 m -77.69 -44.72 27.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.895 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.467 HD13 ' HA ' ' A' ' 78' ' ' SER . 66.0 mt -61.2 -29.78 46.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.228 0.537 . . . . 0.0 109.688 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -63.1 -54.2 41.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.06 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.2 -41.8 99.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.27 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -69.77 -37.56 76.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.816 -176.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.666 ' HB3' ' HB3' ' A' ' 61' ' ' ALA . 25.4 mt -57.12 -43.9 82.8 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 172.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.69 -48.48 88.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.453 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.1 m -69.81 -41.67 74.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.772 0.32 . . . . 0.0 111.845 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.491 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 19.2 t80 -67.47 -34.15 76.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.08 0.467 . . . . 0.0 110.349 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 21.2 m -60.97 -29.88 69.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.664 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 tp -88.3 -26.34 22.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.022 0.439 . . . . 0.0 111.273 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -82.22 -19.09 40.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.423 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -74.61 -173.34 1.77 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.871 -178.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.8 173.34 7.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.909 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.82 -44.33 55.23 Favored Glycine 0 CA--C 1.518 0.273 0 O-C-N 123.502 0.501 . . . . 0.0 114.24 -170.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -59.78 -38.58 82.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.208 0.504 . . . . 0.0 110.667 178.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.5 mt-10 -83.28 -37.51 23.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.936 -175.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -58.04 -45.86 86.29 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.407 ' HD2' ' CD2' ' A' ' 57' ' ' TYR . 40.9 tpt85 -76.43 -30.72 57.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.383 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.888 HD23 HG13 ' A' ' 13' ' ' VAL . 14.9 tp -58.5 -31.0 67.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.002 176.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.694 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 33.9 t -57.36 -30.12 64.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.644 -177.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.407 ' CD2' ' HD2' ' A' ' 54' ' ' ARG . 90.3 m-85 -65.73 -16.72 64.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.971 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.424 ' HB3' HG12 ' A' ' 97' ' ' ILE . 87.5 m-85 -86.28 -48.81 8.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.006 0.432 . . . . 0.0 110.583 175.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 78.6 mt -75.26 -17.35 60.33 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.055 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.49 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 98.92 -108.58 3.61 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -176.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB1' ' SG ' ' A' ' 56' ' ' CYS . . . 50.57 21.82 0.95 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 172.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -140.48 150.99 44.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.139 -178.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -90.54 47.25 1.41 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -151.41 -52.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.921 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.59 104.0 14.85 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.867 -175.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.716 ' O ' HG23 ' A' ' 69' ' ' ILE . . . 49.42 61.19 3.27 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.895 0.747 . . . . 0.0 110.719 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.04 -18.28 56.93 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -167.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.449 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 23.3 ttpp -66.49 -27.83 68.09 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.052 -0.405 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.716 HG23 ' O ' ' A' ' 66' ' ' ALA . 20.4 tt -68.77 -21.82 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -46.12 91.66 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.634 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.1 m -69.0 -30.64 69.08 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.504 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 65.4 mm-40 -66.62 -58.08 5.9 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.372 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.598 ' O ' ' HB2' ' A' ' 77' ' ' MET . 61.4 t -60.76 -44.77 98.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.401 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.9 p -52.92 -35.33 58.23 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -176.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.634 ' HD3' ' O ' ' A' ' 71' ' ' SER . 7.1 mpt_? -63.95 -56.08 27.6 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.487 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.515 ' O ' ' HG3' ' A' ' 81' ' ' MET . 37.8 Cg_endo -70.63 -26.78 23.12 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 121.212 1.275 . . . . 0.0 112.044 173.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.598 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 1.6 tpt -67.0 -19.81 65.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 0.0 110.677 -179.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.467 ' HA ' HD13 ' A' ' 37' ' ' ILE . 67.6 m -73.04 -12.85 61.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.704 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.8 p -130.92 148.87 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.5 m170 -55.42 109.7 0.59 Allowed 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.761 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 26.9 mmm -132.6 164.05 46.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -165.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 32.9 Cg_exo -40.37 3.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.768 1 C-N-CA 128.415 6.076 . . . . 0.0 118.333 169.36 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.473 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.97 -32.83 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.982 2.215 . . . . 0.0 116.982 -159.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.717 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -60.32 -39.49 87.22 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.933 1.242 . . . . 0.0 110.35 173.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 38.2 ttpt -80.56 -14.5 58.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.089 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.473 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 47.5 mt -72.02 -42.79 68.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 46.8 t -69.71 -31.11 68.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.201 0.524 . . . . 0.0 109.607 173.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.432 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 12.0 tp10 -57.42 -48.76 78.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.234 172.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 64.7 mttt -64.9 -29.17 70.1 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 177.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.1 mt -65.56 -14.45 61.12 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.082 -178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.541 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 56.8 mtpt -66.4 -20.33 66.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.58 177.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.584 ' HB3' ' HZ2' ' A' ' 92' ' ' LYS . 3.7 mmmp? -73.16 -21.49 60.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.935 176.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.3 -46.84 5.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.925 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -142.51 119.59 11.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.411 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.4 m -86.74 -13.65 44.68 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.621 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -78.43 -24.77 45.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.708 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.424 HG12 ' HB3' ' A' ' 58' ' ' TYR . 65.4 mt -47.08 -43.26 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.353 179.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.966 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 55.7 m -77.1 -15.67 59.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -168.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.84 39.35 3.54 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.658 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.514 ' HB3' HG23 ' A' ' 13' ' ' VAL . 5.6 mp -74.82 -58.61 3.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 168.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.6 mmtt 68.0 132.95 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.834 0.826 . . . . 0.0 112.815 172.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.752 ' HH ' ' HB2' ' A' ' 16' ' ' GLU . 93.2 m-85 -84.11 -56.07 3.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.853 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -117.17 19.44 14.19 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.623 -0.431 . . . . 0.0 112.104 -171.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -81.87 -50.49 9.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 168.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.251 1.177 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.015 175.46 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 3.1 pt20 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 1' ' ' GLN . 39.7 tt0 173.38 157.0 0.12 Allowed 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -171.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.08 93.54 2.41 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.236 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.56 -50.31 68.27 Favored Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -92.47 169.59 31.76 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 168.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.439 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 10.2 mmt180 -133.54 63.92 66.39 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 117.814 0.807 . . . . 0.0 111.373 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 91.0 Cg_endo -100.42 50.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.19 0 C-N-CA 123.294 2.663 . . . . 0.0 111.413 177.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.628 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -71.26 -34.08 64.36 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.527 -169.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.817 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.52 -90.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.626 0.251 . . . . 0.0 111.16 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -159.32 -73.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.062 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 98' ' ' CYS . 0.6 OUTLIER -84.09 73.28 10.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.657 0.742 . . . . 0.0 112.536 -176.118 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 42.2 mt-10 52.18 -104.17 0.18 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 167.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.599 HG11 HD12 ' A' ' 55' ' ' LEU . 19.0 t -50.17 -51.16 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -161.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.6 t -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.332 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.817 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 7.6 ptpt -72.05 -38.83 69.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 109.913 -178.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.59 -43.51 98.73 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.506 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -62.62 -55.86 23.18 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.366 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.4 mt -62.65 -41.69 99.19 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 121.099 -0.241 . . . . 0.0 111.194 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 2.8 t-20 -62.27 -55.75 25.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.508 0.195 . . . . 0.0 111.399 -176.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.19 -39.12 91.64 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HA ' ' A' ' 41' ' ' LEU . 81.3 t80 -65.91 -49.73 66.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.242 0.544 . . . . 0.0 110.648 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.65 ' HE2' ' H ' ' A' ' 81' ' ' MET . 67.7 t80 -54.39 -37.18 64.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.629 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.7 mmmt -81.06 -47.05 14.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.326 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -56.11 -33.57 65.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.194 -176.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.748 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.4 tp -73.65 -33.2 64.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.941 0.4 . . . . 0.0 110.531 -176.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 25.1 mm -79.99 -34.99 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.5 -43.3 99.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.685 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -71.72 -21.09 61.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.91 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.28 22.72 43.31 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.993 -0.623 . . . . 0.0 111.814 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.748 HG22 ' HG ' ' A' ' 25' ' ' LEU . 32.6 m -105.48 -136.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 CA-C-N 115.095 -0.552 . . . . 0.0 109.802 -177.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.452 ' ND2' ' H ' ' A' ' 32' ' ' PHE . 2.5 t-20 74.1 -177.89 0.17 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.374 0.67 . . . . 0.0 111.444 175.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.452 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 53.1 t80 73.87 -57.12 0.63 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.136 0.974 . . . . 0.0 111.453 -177.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.583 ' O ' HG13 ' A' ' 37' ' ' ILE . 4.1 m -67.39 114.32 5.98 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -55.03 -41.12 70.97 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.801 -177.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -39.14 92.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.477 0.656 . . . . 0.0 110.144 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.558 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 22.1 m -74.1 -41.67 61.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.5 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 33' ' ' SER . 61.5 mt -59.39 -33.96 52.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.83 -54.05 26.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.892 177.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -56.92 -52.88 63.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.152 -177.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' OE2' HG21 ' A' ' 30' ' ' VAL . 11.3 mt-10 -74.62 -20.76 59.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.805 -175.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.607 ' HG ' ' HB3' ' A' ' 61' ' ' ALA . 42.5 tp -63.4 -45.56 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.51 -46.9 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.317 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.471 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 58.4 m -55.34 -52.1 64.6 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.461 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -63.82 -44.92 91.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.373 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 8.1 t -64.42 -43.68 93.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.4 mm? -78.44 -14.31 59.43 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.002 0.429 . . . . 0.0 111.003 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.4 -23.03 40.68 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.572 177.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.52 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -74.3 -165.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.797 179.033 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -93.91 170.31 9.65 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.385 -0.197 . . . . 0.0 111.268 -176.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.78 -45.04 61.09 Favored Glycine 0 C--N 1.329 0.188 0 CA-C-N 115.889 -0.596 . . . . 0.0 114.565 -168.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tppt? -59.07 -41.68 88.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.444 0.64 . . . . 0.0 110.328 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.52 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 18.1 mt-10 -77.41 -34.7 54.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.263 -177.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -62.29 -50.41 71.77 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 13.7 tpt180 -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.102 -0.953 . . . . 0.0 111.18 -177.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.941 HD23 ' HG ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -52.02 -37.96 55.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.84 -179.592 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.762 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 82.0 m -72.19 -14.48 61.81 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.411 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 63.2 m-85 -68.56 -34.34 75.65 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.541 ' CB ' HG12 ' A' ' 97' ' ' ILE . 28.2 m-85 -87.27 -42.3 13.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.422 176.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.941 ' HG ' HD23 ' A' ' 55' ' ' LEU . 31.0 mt -60.95 -34.43 74.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.365 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.618 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 103.65 -7.01 49.45 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.956 -178.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.607 ' HB3' ' HG ' ' A' ' 41' ' ' LEU . . . -76.23 48.2 0.5 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.365 0.602 . . . . 0.0 111.488 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.5 m -155.2 120.67 4.99 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -80.97 41.21 0.57 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.324 0.583 . . . . 0.0 111.091 -175.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -130.43 -6.76 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.268 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.84 -152.43 0.5 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.674 -175.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.41 125.17 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.947 0.403 . . . . 0.0 110.321 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.0 p -80.35 -33.54 37.26 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.066 -172.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 52.8 tttp -66.9 -42.74 84.97 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.368 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.618 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.0 tt -64.68 -28.39 44.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.814 0.34 . . . . 0.0 110.937 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tt -61.06 -47.8 84.67 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 172.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.513 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.7 m -64.51 -34.67 78.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.463 177.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 51.7 mm-40 -62.77 -23.87 67.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.259 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' MET . 59.8 t -87.66 -56.07 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.205 0.526 . . . . 0.0 110.713 172.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.569 HG21 HG22 ' A' ' 37' ' ' ILE . 20.7 p -59.22 -37.04 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -172.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.6 mpt_? -64.53 -54.82 34.17 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.581 -176.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.403 ' HB3' ' HE1' ' A' ' 81' ' ' MET . 13.8 Cg_endo -62.09 -35.16 77.45 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.224 1.283 . . . . 0.0 111.462 173.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.495 ' HB3' HG23 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -62.5 -13.31 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.898 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.486 ' HA ' HD12 ' A' ' 37' ' ' ILE . 29.2 t -62.14 -26.33 68.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.212 0.53 . . . . 0.0 110.476 177.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 8.4 p -123.57 152.9 28.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -58.11 120.34 8.43 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.859 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 1.4 mmt -125.5 149.85 66.05 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -161.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.859 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 66.7 Cg_exo -43.88 2.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.479 0.668 1 C-N-CA 127.27 5.314 . . . . 0.0 116.406 165.04 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 81' ' ' MET . . . -37.98 -22.5 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -158.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.628 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -48.13 -40.6 24.14 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 118.538 0.608 . . . . 0.0 110.223 164.903 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.0 ttpt -87.22 -23.43 24.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.207 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.483 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 60.3 mt -64.36 -33.9 65.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.96 0.409 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.486 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 49.0 t -64.71 -30.16 71.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.4 0.619 . . . . 0.0 110.528 176.415 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 49.2 mt-10 -73.26 -32.9 64.96 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.927 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.64 -40.54 92.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.38 0.609 . . . . 0.0 109.7 173.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.555 ' HA ' HD11 ' A' ' 93' ' ' LEU . 94.4 mt -69.14 -17.67 63.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.384 -178.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.55 ' HD3' ' SG ' ' A' ' 98' ' ' CYS . 13.9 mmmm -65.26 -21.9 66.79 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.953 0.406 . . . . 0.0 110.664 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -77.45 -27.31 52.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.171 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 90' ' ' LEU . 6.2 mp -83.43 -45.8 13.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.838 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.662 ' HB3' HG13 ' A' ' 97' ' ' ILE . 10.7 t70 -154.09 129.82 10.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.55 177.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.3 t -82.47 -35.61 27.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.019 -176.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.483 ' HA ' ' HB2' ' A' ' 99' ' ' GLU . 27.2 tt0 -69.94 -12.9 61.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.253 -174.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.662 HG13 ' HB3' ' A' ' 94' ' ' ASP . 38.2 mt -43.76 -55.17 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.601 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 26.6 p -91.94 -19.13 22.76 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.669 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 96' ' ' GLN . 42.8 mt-10 -88.71 17.32 5.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.372 -175.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.542 HD12 ' HG ' ' A' ' 55' ' ' LEU . 74.7 mt -62.26 -42.37 99.27 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.425 ' HE2' ' HA ' ' A' ' 99' ' ' GLU . 56.4 mmtt 68.76 141.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.084 0.865 . . . . 0.0 111.605 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -76.61 70.76 3.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.959 176.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 68.79 105.28 0.05 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.29 -177.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -82.67 77.11 9.47 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.254 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.842 -179.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.429 ' HB3' ' HG2' ' A' ' 20' ' ' ARG . 79.0 mt-30 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.738 ' HG2' ' H ' ' A' ' 4' ' ' GLY . 35.2 tt0 72.99 150.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.957 0.786 . . . . 0.0 111.099 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.727 ' HB3' ' HG2' ' A' ' 7' ' ' PRO . . . -114.44 4.75 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.181 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.738 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . 112.27 92.22 2.04 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.979 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.94 19.9 18.08 Favored Glycine 0 N--CA 1.454 -0.124 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.377 177.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.433 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 18.3 mmm180 53.29 59.44 13.13 Favored Pre-proline 0 N--CA 1.468 0.427 0 C-N-CA 122.871 0.469 . . . . 0.0 110.862 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.727 ' HG2' ' HB3' ' A' ' 3' ' ' ALA . 2.0 Cg_endo -84.93 55.65 4.34 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.063 2.509 . . . . 0.0 111.351 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.913 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -90.46 -35.5 7.39 Favored Glycine 0 N--CA 1.441 -1.022 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.456 -173.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 173.26 -149.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -123.39 -24.44 4.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.483 0.658 . . . . 0.0 109.81 178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 21.2 m -76.55 1.02 17.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.832 -175.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.423 ' CA ' ' HB3' ' A' ' 15' ' ' LYS . 26.4 tp10 69.55 -74.3 0.08 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.942 171.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.667 ' HB ' ' O ' ' A' ' 101' ' ' LYS . 6.6 p -57.83 -46.77 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-O 121.639 0.733 . . . . 0.0 109.727 178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.621 ' HA ' HD23 ' A' ' 55' ' ' LEU . 8.4 t -68.45 -31.67 71.14 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.302 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.578 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 9.9 ttmt -59.24 -53.25 60.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.332 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.596 ' HG3' ' OH ' ' A' ' 102' ' ' TYR . 22.4 mm-40 -55.21 -49.98 70.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.057 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -62.02 -55.04 33.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.576 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.422 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 85.7 mt -56.7 -53.84 53.1 Favored 'General case' 0 C--O 1.223 -0.295 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -173.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.913 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.3 t-20 -67.44 -40.09 85.41 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.397 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.56 HH22 HG21 ' A' ' 48' ' ' THR . 35.6 mtp180 -65.03 -43.34 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.588 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.518 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 55.0 t80 -64.37 -47.27 79.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.3 0.572 . . . . 0.0 109.829 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -51.57 -42.17 61.67 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.648 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.5 mmmt -84.09 -37.76 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.508 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -60.5 -32.27 71.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.156 -178.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 22.9 mt -70.56 -27.92 64.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.022 0.439 . . . . 0.0 110.77 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 27.9 mm -80.18 -48.68 19.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.38 -44.91 95.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.452 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HB2' HG12 ' A' ' 30' ' ' VAL . 62.8 mtp180 -79.43 -13.79 59.36 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.09 28.76 59.81 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.046 178.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.434 HG23 ' HG3' ' A' ' 40' ' ' GLU . 1.4 p -124.23 92.97 2.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.171 0.51 . . . . 0.0 109.858 -175.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -158.87 178.62 9.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.855 -174.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 25.6 t80 75.91 -55.39 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.462 1.105 . . . . 0.0 112.301 175.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.729 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 8.6 m -60.79 118.39 6.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.083 0.468 . . . . 0.0 110.91 -177.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.27 -41.72 89.52 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.578 -174.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.61 -26.14 60.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.729 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 18.7 m -74.77 -45.49 43.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.302 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.601 HG21 ' HA ' ' A' ' 74' ' ' THR . 21.9 mm -58.45 -34.29 50.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.41 -52.18 59.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.75 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.733 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -57.42 -37.31 72.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.775 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.434 ' HG3' HG23 ' A' ' 30' ' ' VAL . 59.1 mm-40 -85.13 -28.63 25.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.849 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.44 -42.5 92.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.1 mt -61.48 -52.19 64.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.843 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -65.04 -44.71 88.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.955 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -70.84 -27.02 63.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.47 . . . . 0.0 110.287 -176.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.5 t -62.95 -25.66 68.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.981 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -85.83 -37.5 19.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.47 56.41 3.57 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.563 0.697 . . . . 0.0 110.365 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.762 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -153.99 -173.4 4.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.487 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -97.35 171.89 8.12 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.416 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.21 29.9 Favored Glycine 0 C--N 1.331 0.252 0 O-C-N 123.603 0.565 . . . . 0.0 114.039 -173.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.744 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 0.6 OUTLIER -56.98 -43.87 82.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.951 0.405 . . . . 0.0 110.888 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.762 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 12.5 mt-10 -82.64 -32.84 28.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.97 -176.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -61.04 -37.1 81.4 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 18.7 tpt180 -82.07 -32.61 30.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.071 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.828 ' HA ' ' CZ ' ' A' ' 58' ' ' TYR . 34.9 tp -50.08 -46.94 53.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.236 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' SG ' HG23 ' A' ' 62' ' ' THR . 1.6 p -63.72 -17.78 63.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.722 -174.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.8 m-85 -62.75 -51.0 68.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.828 ' CZ ' ' HA ' ' A' ' 55' ' ' LEU . 1.8 p90 -87.32 -17.52 32.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.23 -175.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.2 mt -78.08 -31.1 49.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.416 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 106.27 91.31 2.21 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.872 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . . . -160.06 -53.48 0.05 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.115 0.484 . . . . 0.0 110.044 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.505 HG23 ' SG ' ' A' ' 56' ' ' CYS . 2.9 p -82.3 139.35 34.22 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.58 178.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -81.81 6.35 15.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -90.17 5.8 45.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.539 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.54 -152.06 0.4 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.888 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.26 110.88 2.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.153 0.501 . . . . 0.0 110.908 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.9 p -84.99 -19.01 32.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.456 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -71.96 -47.33 53.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.232 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.512 HD13 HD21 ' A' ' 90' ' ' LEU . 14.5 tt -65.83 -16.94 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.11 -176.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.3 tt -54.17 -46.32 72.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.329 0.585 . . . . 0.0 109.624 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 m -67.89 -25.13 65.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.791 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -73.51 -18.17 61.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.408 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 44.5 t -88.54 -47.67 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.166 0.507 . . . . 0.0 110.848 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.601 ' HA ' HG21 ' A' ' 37' ' ' ILE . 55.9 p -59.06 -39.6 82.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.453 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.3 OUTLIER -61.31 -55.52 42.77 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.827 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.688 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 11.8 Cg_endo -61.05 -42.09 39.05 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 121.223 1.282 . . . . 0.0 112.742 177.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mmt -64.28 -20.69 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.676 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 33.6 t -60.36 -27.26 67.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.485 178.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.896 HG12 ' H ' ' A' ' 80' ' ' HIS . 4.7 p -127.5 -87.32 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.001 178.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.896 ' H ' HG12 ' A' ' 79' ' ' VAL . 39.3 m80 -150.69 -80.06 0.12 Allowed 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 177.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.688 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 35.1 mtp 68.81 167.4 0.12 Allowed Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 168.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.562 ' HB2' HG13 ' A' ' 86' ' ' ILE . 18.4 Cg_exo -40.65 -0.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.218 1 C-N-CA 127.553 5.502 . . . . 0.0 118.977 177.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.569 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -34.73 -46.23 0.28 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -156.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.686 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -52.13 -53.71 39.38 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.327 1.06 . . . . 0.0 109.644 174.314 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.485 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 34.2 tttp -76.29 -18.02 59.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.046 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.972 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 20.1 mt -60.67 -40.57 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 O-C-N 122.136 -0.352 . . . . 0.0 110.255 175.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.422 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 14.8 t -67.04 -19.98 65.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.172 0.51 . . . . 0.0 110.698 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 41.5 mt-10 -78.65 -40.23 34.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.448 0.642 . . . . 0.0 109.836 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.972 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.2 mtmp? -67.83 -30.78 70.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.115 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.512 HD21 HD13 ' A' ' 69' ' ' ILE . 18.6 mt -66.81 -17.2 64.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.571 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.596 ' HG2' ' HB2' ' A' ' 98' ' ' CYS . 45.1 mtpt -68.71 -14.31 62.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.319 -177.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 89' ' ' LYS . 34.0 mtmm -62.04 -39.27 91.77 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.014 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.426 ' O ' ' HB2' ' A' ' 94' ' ' ASP . 5.9 mp -91.01 71.73 6.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.58 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 27.9 m-20 72.06 105.21 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.012 -175.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.2 m -70.42 -13.54 62.17 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.029 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -49.83 -34.41 19.71 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.926 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.571 HG23 ' HD2' ' A' ' 58' ' ' TYR . 73.3 mt -52.66 -31.14 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.536 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.651 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 5.0 t -86.54 -18.69 30.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.631 -173.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -111.12 52.38 0.74 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.439 0.638 . . . . 0.0 111.322 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.531 HD23 ' OH ' ' A' ' 58' ' ' TYR . 1.5 mp -103.02 -45.05 5.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.889 169.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.667 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 29.6 mmtp 64.33 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.248 -178.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.744 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.4 m-85 -164.22 -97.59 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 170.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -99.48 -52.68 3.42 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 161.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 104' ' ' LYS . 2.0 mmtm 179.72 -42.46 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.951 -1.477 . . . . 0.0 109.022 169.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.416 HG23 ' O ' ' A' ' 105' ' ' THR . 6.0 t . . . . . 0 C--O 1.248 1.022 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.863 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 9.2 mm100 . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 110.67 -0.122 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.664 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 11.3 pt-20 55.82 -176.3 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.439 1.095 . . . . 0.0 111.945 174.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.17 -0.85 15.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.071 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.407 ' H ' ' HG3' ' A' ' 2' ' ' GLU . . . -64.64 103.5 0.77 Allowed Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.523 176.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.23 -15.9 9.29 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.877 -177.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.444 ' HB2' ' CD ' ' A' ' 7' ' ' PRO . 28.5 ptt180 -138.64 168.32 16.23 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -178.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.444 ' CD ' ' HB2' ' A' ' 6' ' ' ARG . 11.9 Cg_endo -92.07 91.23 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.857 2.372 . . . . 0.0 111.117 -171.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.871 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -72.33 -37.95 58.79 Favored Glycine 0 N--CA 1.439 -1.112 0 C-N-CA 119.601 -1.285 . . . . 0.0 111.936 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.981 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -173.7 -83.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.413 -176.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -162.67 -67.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.816 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.4 m -57.52 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.679 0.612 . . . . 0.0 112.084 -175.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.472 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 4.4 tp10 -170.35 -75.98 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.495 0 O-C-N 122.063 -0.398 . . . . 0.0 111.055 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 100' ' ' LEU . 38.9 t -55.6 -43.06 71.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.712 0.767 . . . . 0.0 109.968 179.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.535 ' HA ' HD23 ' A' ' 55' ' ' LEU . 37.1 t -61.2 -36.16 79.12 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.172 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.623 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 3.2 ptpp? -77.91 -32.84 51.96 Favored 'General case' 0 N--CA 1.458 -0.052 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.11 -177.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 56.9 mm-40 -57.84 -52.5 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.523 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.78 -55.16 32.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.336 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.435 HD12 ' HB2' ' A' ' 9' ' ' ALA . 82.9 mt -61.37 -46.08 91.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 121.335 -0.146 . . . . 0.0 111.207 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.871 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.4 t-20 -62.06 -52.95 61.86 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.987 0.179 . . . . 0.0 111.327 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.664 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 51.1 mtm-85 -65.4 -41.86 93.21 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.562 -177.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -59.05 -49.13 79.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.831 0.824 . . . . 0.0 109.584 178.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.531 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 70.0 t80 -53.73 -55.35 27.04 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.256 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -67.39 -34.02 76.41 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.7 m -62.3 -33.9 75.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.933 0.397 . . . . 0.0 111.271 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.735 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.6 mp -77.46 -39.83 45.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.35 -45.84 92.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.246 0.546 . . . . 0.0 109.772 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.71 -51.53 68.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.569 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.705 ' HB2' HG11 ' A' ' 30' ' ' VAL . 90.2 mtm-85 -78.25 -13.47 59.84 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.8 25.87 68.51 Favored Glycine 0 CA--C 1.509 -0.322 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 -176.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.735 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 4.0 p -109.28 57.91 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 122.425 1.107 . . . . 0.0 109.683 -173.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.7 t-20 -140.7 -179.09 5.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.06 -172.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.451 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 44.8 t80 73.09 -55.84 0.67 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.254 1.021 . . . . 0.0 111.329 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.484 ' O ' HG13 ' A' ' 37' ' ' ILE . 22.3 m -60.52 109.75 1.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.834 0.349 . . . . 0.0 110.644 178.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.614 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.3 mm? -59.66 -38.88 82.67 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.858 -175.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -61.15 -38.39 86.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.311 0.577 . . . . 0.0 110.626 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 m -76.43 -41.65 46.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.196 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 33' ' ' SER . 61.1 mt -60.44 -32.3 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.13 -50.56 69.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.509 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.1 tptt -62.95 -35.2 79.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.844 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -74.2 -36.74 64.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.67 -178.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.439 HD13 HG22 ' A' ' 74' ' ' THR . 17.1 mt -58.36 -38.78 77.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 172.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.749 HG12 ' HA ' ' A' ' 62' ' ' THR . 96.1 mt -65.43 -49.3 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.905 176.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -63.64 -55.36 24.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.031 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -61.68 -29.45 70.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.666 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.539 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.5 t -54.23 -50.77 66.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 175.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.1 mt -88.42 -14.57 37.68 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.812 0.339 . . . . 0.0 111.833 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -94.93 -1.74 51.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 111.385 -174.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.768 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -85.58 -161.71 0.64 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.856 177.025 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -93.87 169.54 10.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.612 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -46.73 -52.24 11.68 Favored Glycine 0 N--CA 1.453 -0.176 0 O-C-N 123.769 0.668 . . . . 0.0 114.26 -170.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -63.72 -39.93 95.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.244 0.522 . . . . 0.0 110.821 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.768 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 50.3 mt-10 -72.21 -31.19 65.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.515 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.539 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 12.9 m120 -66.79 -21.05 66.05 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.667 175.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.612 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 7.0 mmm180 -86.01 -44.6 12.18 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.555 HD11 HG21 ' A' ' 97' ' ' ILE . 27.8 tp -59.58 -24.87 64.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.427 -1.26 . . . . 0.0 112.598 -172.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 7.6 p -63.84 -34.85 78.85 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.536 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -74.84 -17.09 60.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.147 0.498 . . . . 0.0 110.003 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.522 ' HB3' HG12 ' A' ' 97' ' ' ILE . 63.0 m-85 -85.41 -51.59 6.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.759 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.29 -46.65 89.42 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.962 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.549 ' O ' ' HA ' ' A' ' 70' ' ' LEU . . . 131.9 59.78 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.968 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.409 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . . . -128.85 169.53 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.749 ' HA ' HG12 ' A' ' 42' ' ' ILE . 16.9 p 66.21 142.66 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.295 1.038 . . . . 0.0 111.65 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.555 ' HZ1' ' HB3' ' A' ' 63' ' ' LYS . 9.3 mtpm? -90.73 19.05 5.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -93.12 -27.81 16.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.814 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.81 -167.28 1.39 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.273 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.73 119.93 5.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.055 0.455 . . . . 0.0 110.991 178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.26 -16.16 44.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.667 -176.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 27.5 ttpp -62.73 -51.94 65.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.35 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.451 HD12 ' HB2' ' A' ' 72' ' ' GLU . 8.5 tp -65.88 -25.73 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.549 ' HA ' ' O ' ' A' ' 60' ' ' GLY . 2.8 tt -61.4 -45.08 95.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.482 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 45.3 m -66.68 -35.14 79.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.304 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.451 ' HB2' HD12 ' A' ' 69' ' ' ILE . 42.4 mt-10 -68.86 -23.42 64.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.756 -177.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.492 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 91.6 t -88.01 -48.53 15.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.774 0.321 . . . . 0.0 111.371 174.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.439 HG22 HD13 ' A' ' 41' ' ' LEU . 7.9 p -54.02 -47.27 71.7 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -176.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.614 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.1 mpt_? -58.09 -53.29 67.45 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.745 -177.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.527 ' CA ' ' HG3' ' A' ' 81' ' ' MET . 52.7 Cg_exo -56.74 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.78 1.654 . . . . 0.0 113.1 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.5 mmt -62.69 -14.05 39.47 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.823 0.344 . . . . 0.0 111.749 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 31.5 t -74.27 -14.87 60.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.262 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.665 HG21 ' H ' ' A' ' 80' ' ' HIS . 4.4 p -136.18 -178.15 2.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.665 ' H ' HG21 ' A' ' 79' ' ' VAL . 60.0 t-80 -56.09 -64.29 0.91 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 117.869 0.304 . . . . 0.0 110.336 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER 67.04 146.39 0.11 Allowed Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 51.7 Cg_exo -41.87 0.99 0.0 OUTLIER 'Trans proline' 0 C--O 1.21 -0.878 1 C-N-CA 126.838 5.025 . . . . 0.0 117.723 167.039 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.583 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.1 -34.53 0.06 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -159.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.981 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 1.1 mpp? -55.88 -56.64 18.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.872 0.844 . . . . 0.0 109.559 171.128 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 82' ' ' PRO . 44.4 mttm -68.54 -19.87 64.52 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.616 -1.174 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.583 HD12 ' HA ' ' A' ' 83' ' ' ALA . 24.7 mt -60.87 -29.63 45.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.046 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.532 ' CB ' ' HB3' ' A' ' 9' ' ' ALA . 46.0 t -72.04 -34.34 68.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.428 0.632 . . . . 0.0 110.026 176.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.563 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 51.0 mt-10 -69.09 -41.12 77.91 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.681 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.526 ' HG2' ' HA ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -76.11 -28.21 57.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.669 177.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.9 mt -67.63 -28.15 67.48 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.995 176.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.563 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 25.7 mtpp -60.75 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.958 176.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -79.15 -13.89 59.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.374 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.2 mp -100.21 -49.57 4.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.647 174.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -142.09 118.78 11.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.906 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.2 p -85.65 -15.11 43.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.798 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.403 HE21 ' HB2' ' A' ' 96' ' ' GLN . 16.1 mt-30 -71.13 -29.99 65.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 -177.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.555 HG21 HD11 ' A' ' 55' ' ' LEU . 95.4 mt -50.87 -40.36 20.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.907 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.402 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 49.6 t -71.36 -52.26 19.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.357 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -97.2 36.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.717 -171.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.591 ' O ' HG23 ' A' ' 13' ' ' VAL . 10.1 tp -84.65 37.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 104' ' ' LYS . 34.0 mmtp -54.02 145.54 16.51 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -172.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -63.0 114.2 3.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.351 -173.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 58.08 35.74 25.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.57 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 101' ' ' LYS . 16.2 tppt? -87.37 72.95 9.7 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 171.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.461 -173.122 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.624 ' HB3' ' HE3' ' A' ' 23' ' ' LYS . 9.6 tp10 -154.95 148.27 25.03 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.392 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 1.018 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . . . -153.46 -153.62 0.48 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.15 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 90.06 101.6 1.13 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.029 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.51 60.02 9.72 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.312 -0.47 . . . . 0.0 112.17 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -111.31 154.02 43.83 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 120.68 0.276 . . . . 0.0 111.604 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -97.2 64.08 0.11 Allowed 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.916 3.077 . . . . 0.0 111.846 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.748 ' H ' ' HD3' ' A' ' 15' ' ' LYS . . . -73.08 -42.64 43.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.107 -176.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.645 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -166.92 -82.68 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.175 0.512 . . . . 0.0 110.963 -172.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -162.16 -62.53 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.319 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 14' ' ' CYS . 4.8 p -77.76 148.13 34.98 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.24 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.574 ' HA ' ' HZ1' ' A' ' 15' ' ' LYS . 40.5 tt0 -58.91 -72.08 0.11 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -172.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.824 HG21 HD22 ' A' ' 55' ' ' LEU . 6.1 p -51.38 -48.65 33.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -170.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.456 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 33.9 t -62.97 -43.18 99.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.924 0.392 . . . . 0.0 110.877 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.748 ' HD3' ' H ' ' A' ' 8' ' ' GLY . 5.2 ptpp? -72.32 -42.13 65.75 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.578 -175.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.604 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 37.0 mm-40 -57.88 -42.73 85.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.535 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -60.0 -51.46 69.57 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.418 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.5 mt -60.34 -45.04 94.87 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -50.92 -56.39 12.58 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 123.52 0.512 . . . . 0.0 112.109 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 1.018 ' HD2' ' HB2' ' A' ' 3' ' ' ALA . 0.9 OUTLIER -58.67 -55.24 37.65 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.719 -177.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 69.2 t80 -59.08 -48.22 82.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.203 0.525 . . . . 0.0 111.073 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.4 t80 -53.3 -48.41 68.41 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.188 -174.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.624 ' HE3' ' HB3' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -85.69 -39.26 17.42 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.504 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -61.96 -32.44 72.87 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.761 0.315 . . . . 0.0 111.356 -178.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.746 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 11.5 tp -61.63 -41.94 98.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.307 0.575 . . . . 0.0 109.992 177.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.3 mm -75.26 -38.06 40.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.455 -177.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.14 -45.91 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.596 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -70.08 -23.7 63.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.051 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.36 -5.58 67.84 Favored Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.985 -0.626 . . . . 0.0 111.657 174.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.746 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -86.48 122.41 38.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.048 -0.576 . . . . 0.0 110.201 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.412 HD21 ' HA ' ' A' ' 31' ' ' ASN . 1.3 t-20 -172.03 -177.99 2.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 174.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.455 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 94.9 m-85 71.19 -58.36 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.628 0.771 . . . . 0.0 112.145 178.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 37' ' ' ILE . 12.5 m -64.2 109.07 1.74 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.847 0.356 . . . . 0.0 110.15 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.577 HD13 ' HA ' ' A' ' 75' ' ' ARG . 2.6 mm? -59.86 -37.74 80.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.874 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.08 -36.57 82.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.54 0.686 . . . . 0.0 110.045 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.417 HG22 ' CG2' ' A' ' 30' ' ' VAL . 56.6 m -80.09 -38.78 31.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.49 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 33' ' ' SER . 72.1 mt -62.89 -34.75 67.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -72.96 -38.74 66.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.554 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -58.49 -47.73 83.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 175.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.507 ' HG3' HG22 ' A' ' 30' ' ' VAL . 6.7 mm-40 -68.47 -41.42 80.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.526 -176.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.557 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 13.6 mt -55.79 -44.9 78.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 175.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.456 HD11 ' HD3' ' A' ' 63' ' ' LYS . 69.1 mt -62.7 -52.41 60.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.138 178.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.1 m -58.94 -47.34 85.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.959 0.409 . . . . 0.0 111.21 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.615 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 30.2 t80 -65.84 -36.25 82.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.746 -176.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.577 ' SG ' ' HB1' ' A' ' 61' ' ' ALA . 6.5 m -69.33 -33.29 72.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.8 mt -85.29 -31.7 22.92 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.373 -0.531 . . . . 0.0 109.938 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.25 70.02 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.72 0.771 . . . . 0.0 110.305 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.441 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -159.1 -162.33 1.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.284 177.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.64 170.41 9.35 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.286 -0.566 . . . . 0.0 111.145 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.53 -48.37 60.8 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.174 -169.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.791 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 11.5 mptt -67.44 -25.74 66.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.448 0.624 . . . . 0.0 111.562 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.441 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 36.5 mt-10 -77.97 -49.38 14.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -58.16 -40.59 81.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.467 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 54' ' ' ARG . 27.2 tpt85 -69.97 -40.35 75.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.214 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.824 HD22 HG21 ' A' ' 13' ' ' VAL . 43.8 tp -61.25 -34.09 74.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.092 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 64.4 m -68.41 -14.71 63.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -67.7 -29.32 68.55 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -85.54 -39.3 17.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.092 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.552 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 66.8 mt -67.33 -31.93 72.54 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.183 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.5 ' HA3' HG22 ' A' ' 69' ' ' ILE . . . 109.31 -18.13 30.79 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.873 176.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.577 ' HB1' ' SG ' ' A' ' 45' ' ' CYS . . . -80.58 67.46 6.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.457 0.646 . . . . 0.0 111.393 -177.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.466 HG23 ' H ' ' A' ' 64' ' ' ASP . 25.0 m -155.15 145.7 22.17 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.456 ' HD3' HD11 ' A' ' 42' ' ' ILE . 31.9 mmmt -76.46 2.97 12.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.261 0.553 . . . . 0.0 110.858 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.466 ' H ' HG23 ' A' ' 62' ' ' THR . 19.9 m-20 -125.27 29.34 6.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.334 171.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.409 ' HB2' ' HB ' ' A' ' 62' ' ' THR . . . -133.28 170.84 14.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.464 -178.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.51 117.46 18.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.047 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.481 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . 39.7 p -73.37 -14.1 61.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.712 -178.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -58.67 -56.33 23.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.62 0.248 . . . . 0.0 110.728 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.5 HG22 ' HA3' ' A' ' 60' ' ' GLY . 14.5 tt -69.23 -25.73 30.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.042 0.449 . . . . 0.0 110.377 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.481 ' HB3' ' HA ' ' A' ' 67' ' ' THR . 20.2 tp -60.24 -48.67 80.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.686 174.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.566 ' HA ' ' HG1' ' A' ' 74' ' ' THR . 20.8 m -66.05 -29.28 69.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.41 -21.43 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.965 175.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.517 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 57.3 t -87.65 -45.0 16.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.809 0.338 . . . . 0.0 111.35 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.566 ' HG1' ' HA ' ' A' ' 71' ' ' SER . 28.7 p -57.72 -41.5 81.88 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.577 ' HA ' HD13 ' A' ' 34' ' ' LEU . 10.5 mpt_? -59.01 -54.97 51.22 Favored Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.611 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.577 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 50.5 Cg_exo -56.6 -43.13 58.03 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.946 1.764 . . . . 0.0 113.24 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.3 mmt -62.91 -13.75 38.25 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.455 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 40.6 t -69.64 -12.31 61.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.574 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.794 HG21 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -153.73 -166.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.794 ' H ' HG21 ' A' ' 79' ' ' VAL . 36.4 t-80 -60.54 -71.8 0.13 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.886 0.312 . . . . 0.0 110.911 -176.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.749 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 48.8 mmm 64.24 158.0 0.12 Allowed Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 170.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.749 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 52.1 Cg_exo -41.26 1.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.033 1 C-N-CA 128.4 6.067 . . . . 0.0 118.92 172.257 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.644 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -38.39 -24.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -162.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.637 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -67.96 -58.88 3.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.44 1.018 . . . . 0.0 109.963 173.233 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.456 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 64.0 pttt -76.62 -12.14 59.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 -176.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.661 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 16.8 mt -54.52 -35.23 31.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 173.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 48.8 t -71.34 -29.11 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.166 0.508 . . . . 0.0 110.319 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.635 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 9.0 tp10 -70.8 -38.5 73.34 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.562 0.696 . . . . 0.0 109.144 174.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.661 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.09 -20.94 64.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.119 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.48 HD22 HD11 ' A' ' 69' ' ' ILE . 79.9 mt -78.87 -34.18 45.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.958 173.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.648 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 48.7 mtpt -62.91 -27.3 69.28 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.449 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -60.02 -29.23 68.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.627 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -96.4 -50.88 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.086 0.47 . . . . 0.0 110.258 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.648 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 12.5 t70 -134.57 123.5 23.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.3 m -86.2 -15.28 41.41 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -86.07 -25.66 25.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.171 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.557 HG22 ' O ' ' A' ' 94' ' ' ASP . 14.7 tt -55.47 -31.52 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 121.198 0.523 . . . . 0.0 110.89 178.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.502 ' SG ' ' HD2' ' A' ' 91' ' ' LYS . 6.6 t -75.7 -55.73 5.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.364 0.602 . . . . 0.0 109.509 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -91.07 49.48 1.64 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.225 -176.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.587 ' HB3' HG12 ' A' ' 13' ' ' VAL . 0.6 OUTLIER -76.23 -47.85 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 176.8 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.591 ' H ' HG12 ' A' ' 13' ' ' VAL . 71.2 mmtt 66.37 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.532 0.733 . . . . 0.0 111.687 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . 0.791 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 96.9 m-85 -79.23 41.84 0.47 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.576 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 37.19 48.98 0.82 Allowed 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.881 0.848 . . . . 0.0 110.437 -170.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.717 ' HG3' ' H ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -73.05 -75.58 0.14 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.098 -169.904 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.717 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 69.2 p . . . . . 0 C--O 1.248 0.977 0 O-C-N 123.991 0.807 . . . . 0.0 111.678 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 5.6 mp0 -43.26 123.1 2.79 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.673 0.789 . . . . 0.0 111.073 178.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.77 125.39 22.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.095 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 87.35 -79.09 1.8 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.79 -178.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -150.06 -89.22 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.623 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.46 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 27.7 mmt85 -143.51 60.47 8.69 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 122.345 0.258 . . . . 0.0 110.482 176.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.479 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 4.8 Cg_endo -87.06 49.36 1.94 Allowed 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.925 2.416 . . . . 0.0 111.325 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.694 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -75.87 -26.96 63.54 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.33 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.475 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . 177.12 -130.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 123.337 0.655 . . . . 0.0 109.421 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -132.81 -47.2 0.87 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.84 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 48.2 m -77.69 21.25 0.3 Allowed 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.646 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 34.3 tt0 71.4 -67.56 0.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 174.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.772 HG12 HD23 ' A' ' 55' ' ' LEU . 43.8 t -63.28 -55.66 21.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -170.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.742 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.4 p -64.33 -31.1 72.17 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.646 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 12.7 ttmt -58.88 -53.9 53.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.5 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.459 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 50.2 mm-40 -49.68 -54.67 17.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.655 176.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.32 -54.4 47.39 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.092 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.787 HD11 ' HB2' ' A' ' 87' ' ' CYS . 96.3 mt -57.44 -53.93 52.61 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.694 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -70.61 -43.36 69.47 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.854 -173.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.556 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 46.7 mtp180 -61.33 -41.23 96.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.195 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.407 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 41.1 t80 -59.47 -49.25 78.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.968 0.889 . . . . 0.0 109.631 175.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.579 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 25.7 t80 -58.05 -55.57 33.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.762 -1.563 . . . . 0.0 111.801 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HD2' ' N ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -67.14 -27.72 67.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.714 0.293 . . . . 0.0 110.997 -176.149 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.478 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 17.0 t -68.82 -46.13 69.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.599 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -56.85 -52.84 63.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.913 -179.57 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.55 -40.29 88.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.386 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -69.28 -40.24 77.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.033 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -62.55 -31.53 72.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.965 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.3 8.92 40.14 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 174.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.511 HG21 ' N ' ' A' ' 31' ' ' ASN . 5.1 m -89.59 -154.98 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.964 -0.618 . . . . 0.0 109.539 179.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 1.083 ' HA ' HD12 ' A' ' 37' ' ' ILE . 22.9 t-20 78.94 91.55 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.747 0.784 . . . . 0.0 112.984 168.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 17.8 t80 166.45 -30.39 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.682 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.48 ' O ' HG12 ' A' ' 37' ' ' ILE . 13.4 m -87.98 117.24 26.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.692 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.1 mm? -63.69 -41.04 98.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.307 -172.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.63 -25.89 65.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.449 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 89.7 m -78.97 -43.98 23.36 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.86 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 1.083 HD12 ' HA ' ' A' ' 31' ' ' ASN . 47.2 mm -58.61 -31.05 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.527 ' HG3' HD13 ' A' ' 70' ' ' LEU . 28.3 tt0 -57.33 -47.77 80.71 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.563 174.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.571 ' HD2' HD12 ' A' ' 42' ' ' ILE . 14.0 mmmm -76.5 -35.2 58.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.921 -178.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' HB3' HD12 ' A' ' 25' ' ' LEU . 23.8 mm-40 -62.18 -40.72 96.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.305 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.407 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 19.4 mt -58.9 -33.16 70.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.742 HG12 ' H ' ' A' ' 62' ' ' THR . 76.9 mt -74.64 -46.89 40.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.671 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.9 t -61.89 -47.54 84.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.361 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.556 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 32.1 t80 -68.31 -27.88 66.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.364 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 20.3 t -61.08 -28.97 69.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.004 0.43 . . . . 0.0 110.603 174.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -85.98 -42.04 14.35 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -78.17 49.07 0.79 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.03 0.443 . . . . 0.0 111.512 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.775 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -144.34 -173.54 4.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.971 178.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.69 175.85 5.51 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 121.211 -0.196 . . . . 0.0 110.626 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.66 -53.55 12.9 Favored Glycine 0 CA--C 1.522 0.477 0 N-CA-C 114.966 0.747 . . . . 0.0 114.966 -170.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -67.02 -29.56 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 117.62 0.71 . . . . 0.0 110.687 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.775 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 71.6 mt-10 -80.63 -36.25 32.88 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.513 -176.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -61.08 -53.33 58.41 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 173.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.44 ' O ' ' HD3' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -57.91 -34.64 70.05 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.842 178.061 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.772 HD23 HG12 ' A' ' 13' ' ' VAL . 42.7 tp -60.93 -32.69 72.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.43 -175.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.401 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 10.3 p -66.94 -21.09 65.99 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.612 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -71.02 -22.96 62.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.127 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.588 ' HB3' HG12 ' A' ' 97' ' ' ILE . 97.3 m-85 -80.47 -35.21 35.16 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.45 -5.53 58.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.844 -179.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 95.17 17.96 35.45 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.992 170.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.401 ' HB1' ' HB2' ' A' ' 56' ' ' CYS . . . -89.31 -179.29 5.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.227 0.513 . . . . 0.0 111.414 -177.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.742 ' H ' HG12 ' A' ' 42' ' ' ILE . 63.2 p 59.6 15.83 4.91 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.531 1.132 . . . . 0.0 113.288 177.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 61.23 -178.94 0.11 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 122.604 0.362 . . . . 0.0 110.903 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.7 t70 71.74 -47.82 0.67 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.435 0.694 . . . . 0.0 110.974 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.27 155.92 27.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.78 112.85 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.889 0.376 . . . . 0.0 111.186 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.0 p -64.9 -14.13 58.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.532 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -49.36 -50.92 37.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.486 HD11 ' O ' ' A' ' 58' ' ' TYR . 18.6 tt -80.67 -24.39 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.699 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.527 HD13 ' HG3' ' A' ' 38' ' ' GLU . 3.4 tm? -57.04 -48.47 78.45 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.584 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 7.8 p -69.56 -35.16 75.14 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.853 177.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.46 -32.62 71.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.784 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.427 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 96.9 t -85.85 -47.08 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.503 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.528 ' HG1' ' HA ' ' A' ' 71' ' ' SER . 7.4 p -55.44 -46.76 76.7 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 34' ' ' LEU . 3.5 mpt_? -56.38 -56.72 28.75 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.949 -177.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.556 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 72.4 Cg_endo -75.26 -13.77 20.79 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 121.465 1.444 . . . . 0.0 113.836 -177.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.2 mmt -74.9 -33.22 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.067 0.46 . . . . 0.0 109.794 172.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.1 m -68.88 -14.5 63.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.561 -173.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.714 HG12 ' HG3' ' A' ' 81' ' ' MET . 6.5 p -139.53 149.53 22.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.579 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 2.0 t60 -58.04 105.32 0.26 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -177.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.714 ' HG3' HG12 ' A' ' 79' ' ' VAL . 45.7 mtp -141.07 174.24 4.09 Favored Pre-proline 0 CA--C 1.541 0.606 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -169.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.666 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 1.9 Cg_endo -40.83 2.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.114 1 C-N-CA 128.301 6.001 . . . . 0.0 118.97 177.305 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.607 ' HA ' HD13 ' A' ' 86' ' ' ILE . . . -35.74 -44.0 0.32 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -159.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.619 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -59.66 -37.62 79.23 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.033 0.833 . . . . 0.0 110.931 177.331 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 38.0 ttpt -84.81 -17.78 37.03 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.978 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.607 HD13 ' HA ' ' A' ' 83' ' ' ALA . 44.9 mt -61.8 -41.66 91.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.407 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' CYS . . . . . 0.787 ' HB2' HD11 ' A' ' 18' ' ' LEU . 46.6 t -64.65 -27.43 68.92 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.66 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 33.7 tt0 -70.06 -31.34 68.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.381 0.61 . . . . 0.0 109.57 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 53.7 mtmt -78.84 -28.61 44.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.92 174.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 88.0 mt -68.4 -23.85 64.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.298 176.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 50.6 mtpt -62.1 -25.04 67.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -75.25 -34.25 61.37 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.31 -52.14 36.94 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.746 ' HB3' HG13 ' A' ' 97' ' ' ILE . 29.2 t0 -160.7 124.61 3.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.263 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.6 m -74.24 -17.96 60.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.083 -176.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -76.13 -14.04 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.081 0.467 . . . . 0.0 110.446 -179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.746 HG13 ' HB3' ' A' ' 94' ' ' ASP . 65.6 mt -67.12 -22.76 29.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.502 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' CYS . . . . . 0.461 ' HB2' ' HB2' ' A' ' 11' ' ' CYS . 14.2 p -117.52 -38.42 3.31 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.492 -176.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -85.11 56.87 4.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.544 ' HB2' HG23 ' A' ' 13' ' ' VAL . 6.1 mp -85.21 -49.37 8.27 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 174.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.7 mmtt 68.55 130.61 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 O-C-N 124.035 0.834 . . . . 0.0 112.079 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -80.74 68.3 6.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.167 -177.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 72.35 -61.15 0.51 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.416 0.686 . . . . 0.0 111.923 176.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt 57.1 74.07 0.43 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.374 0.607 . . . . 0.0 110.455 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.517 -179.748 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo . . . . . 0 N--CA 1.45 -1.084 0 N-CA-C 110.807 -0.497 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.992 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -70.09 -50.83 26.2 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.544 -172.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.868 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -174.1 -91.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -169.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -134.75 -80.7 0.44 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -71.14 -88.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.38 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 36.9 tt0 -163.64 -77.83 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.553 0 O-C-N 122.315 -0.24 . . . . 0.0 110.563 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.813 HG12 HD22 ' A' ' 55' ' ' LEU . 46.6 t -56.95 -40.36 71.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.685 ' HA ' HD21 ' A' ' 55' ' ' LEU . 35.8 t -59.78 -40.68 89.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.085 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.715 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 15.2 ptpt -75.97 -42.54 48.09 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.624 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 4.7 mm-40 -65.74 -40.9 92.6 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.006 -176.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -62.15 -54.82 35.72 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.62 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 95.5 mt -57.84 -52.74 64.21 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 122.957 0.161 . . . . 0.0 110.772 -177.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.992 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -60.14 -51.3 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 123.125 0.266 . . . . 0.0 111.391 -176.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 20' ' ' ARG . 23.4 mtm180 -67.58 -39.37 84.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.218 -175.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -64.2 -41.76 96.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 122.086 0.946 . . . . 0.0 109.667 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.706 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 14.5 t80 -64.81 -55.7 18.04 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.722 -173.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -76.16 -19.33 58.56 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.998 -176.831 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 t -64.59 -55.19 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.013 174.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.611 ' HA ' HG13 ' A' ' 30' ' ' VAL . 3.4 mp -59.74 -40.32 87.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.508 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 22' ' ' TYR . 51.4 mm -64.27 -43.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -74.82 -43.74 53.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.461 -177.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.802 ' HB2' HG12 ' A' ' 30' ' ' VAL . 16.2 mtm180 -67.79 -14.38 62.91 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.007 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.19 28.4 66.33 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 28' ' ' ARG . 3.4 p -111.93 51.81 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 CA-C-O 122.761 1.267 . . . . 0.0 109.27 -175.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.458 ' OD1' ' HA ' ' A' ' 78' ' ' SER . 9.2 t-20 -145.09 -167.32 2.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.318 -177.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.44 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 95.8 m-85 68.67 4.59 4.45 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.575 0.75 . . . . 0.0 111.139 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 15.5 m -128.47 107.35 9.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.255 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.064 -173.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -68.72 -32.75 72.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.238 0.542 . . . . 0.0 110.492 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.478 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 55.3 m -73.11 -42.16 63.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' SER . 53.7 mt -59.27 -32.97 49.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.25 0.547 . . . . 0.0 109.543 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -68.43 -44.16 75.56 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 42' ' ' ILE . 47.5 tptt -69.91 -39.06 76.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.682 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.82 -28.31 62.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.904 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.39 -46.87 82.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 168.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 39' ' ' LYS . 82.5 mt -56.06 -52.11 54.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 176.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.5 m -57.14 -55.66 31.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.714 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.88 -39.4 83.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.084 -173.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 56.9 m -62.93 -39.35 94.32 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.35 -29.4 24.51 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.494 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -92.23 58.71 3.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.709 0.766 . . . . 0.0 110.582 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.98 -164.94 1.98 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.295 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -98.11 167.33 10.95 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.398 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.99 -40.14 19.7 Favored Glycine 0 C--N 1.333 0.382 0 O-C-N 123.839 0.712 . . . . 0.0 114.298 -170.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 5.0 mptp? -51.86 -48.48 63.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.919 0.39 . . . . 0.0 111.221 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -82.99 -35.44 25.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.198 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 9.0 m-20 -62.59 -33.95 76.0 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.56 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 23.5 tpt180 -83.42 -38.96 21.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.851 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 HG12 ' A' ' 13' ' ' VAL . 19.7 tp -55.34 -39.53 70.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.316 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.76 -23.05 65.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 45.6 m-85 -61.78 -27.15 68.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.614 176.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.475 ' HB3' HG12 ' A' ' 97' ' ' ILE . 62.0 m-85 -86.33 -19.96 29.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.85 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.7 mt -102.2 -22.5 14.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.365 -174.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 124.73 -128.56 6.76 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.205 -0.522 . . . . 0.0 111.822 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.766 ' H ' ' HG ' ' A' ' 70' ' ' LEU . . . 57.24 -167.72 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 112.201 175.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 58.3 p 56.68 11.04 0.8 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.085 0.954 . . . . 0.0 112.922 177.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt 60.8 13.98 4.81 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.879 0.472 . . . . 0.0 111.467 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' HB3' ' H ' ' A' ' 65' ' ' ALA . 3.4 m-20 -151.28 -161.65 1.38 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.088 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . 70.94 -84.03 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 O-C-N 123.817 0.698 . . . . 0.0 111.38 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.02 104.48 5.25 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.92 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.5 p -83.84 -26.31 29.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -77.09 -47.28 20.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.029 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.1 tt -64.7 -21.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.766 ' HG ' ' H ' ' A' ' 61' ' ' ALA . 2.7 tt -55.06 -44.84 75.15 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.075 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.609 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 81.8 p -65.4 -29.57 70.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -74.19 -14.04 60.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.039 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 52.9 t -88.25 -55.88 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.186 0.517 . . . . 0.0 110.615 171.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.403 HG22 HG22 ' A' ' 37' ' ' ILE . 34.4 p -58.25 -42.51 86.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.579 -173.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.609 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.1 mpt_? -59.14 -55.1 49.81 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.474 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 50.4 Cg_endo -72.18 -14.41 28.68 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.52 1.48 . . . . 0.0 113.17 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -14.09 59.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.806 0.336 . . . . 0.0 110.51 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.458 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 43.6 t -80.9 -13.67 58.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.774 -177.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.73 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.2 p -146.36 149.53 15.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -175.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.706 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 5.7 t60 -60.38 107.78 0.71 Allowed 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.73 ' HG3' HG13 ' A' ' 79' ' ' VAL . 34.6 mtp -140.68 170.36 9.7 Favored Pre-proline 0 CA--C 1.533 0.317 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -167.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.498 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 23.8 Cg_exo -41.25 2.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.865 1 C-N-CA 128.149 5.899 . . . . 0.0 119.125 174.447 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.6 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.5 -24.37 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 -166.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.868 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -65.2 -57.44 8.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.819 0.819 . . . . 0.0 109.477 170.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.7 ttpt -70.27 -14.45 62.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.732 179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 83' ' ' ALA . 38.2 mt -66.12 -27.09 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 122.06 -0.4 . . . . 0.0 110.539 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.685 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 50.8 t -75.61 -22.87 56.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.611 0.72 . . . . 0.0 109.65 175.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.8 mt-10 -75.64 -38.41 58.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.168 173.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -62.65 -35.99 81.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.647 171.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 87' ' ' CYS . 21.4 mt -61.81 -28.68 69.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.313 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.589 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.7 mmmm -65.85 -24.06 66.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.602 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -81.69 -14.63 56.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.924 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.548 HD12 HD23 ' A' ' 90' ' ' LEU . 96.3 mt -94.37 -39.83 10.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.163 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -162.38 137.47 7.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.974 175.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 41.7 t -85.07 -21.92 29.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.163 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -68.59 -19.71 64.47 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.829 0.347 . . . . 0.0 110.844 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' HB3' ' A' ' 58' ' ' TYR . 51.7 mt -61.0 -30.17 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.305 0.574 . . . . 0.0 110.283 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.589 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 44.3 t -85.96 79.72 9.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.167 176.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 179.37 -139.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.896 174.015 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.557 ' O ' HG21 ' A' ' 13' ' ' VAL . 6.7 mp 63.63 21.98 12.95 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.739 0.649 . . . . 0.0 111.131 177.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.441 ' HG2' ' OE1' ' A' ' 99' ' ' GLU . 33.4 mmtp -46.15 134.53 8.39 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 123.729 0.643 . . . . 0.0 112.078 -170.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.598 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.0 m-85 . . . . . 0 C--N 1.327 -0.403 0 O-C-N 123.388 0.43 . . . . 0.0 110.934 -174.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo . . . . . 0 N--CA 1.45 -1.053 0 CA-C-O 120.654 0.189 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -85.78 -37.46 9.41 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.818 -1.182 . . . . 0.0 112.271 -177.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LYS . . . 175.33 -109.54 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.19 0.596 . . . . 0.0 109.879 -174.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -149.85 -35.22 0.17 Allowed 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 172.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 91.8 m -67.67 101.98 1.12 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.982 0.42 . . . . 0.0 109.943 173.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 39.3 tt0 -46.3 -59.9 2.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.645 -1.161 . . . . 0.0 113.895 -165.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.967 HG12 HD22 ' A' ' 55' ' ' LEU . 23.1 t -64.11 -47.97 87.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.356 0.598 . . . . 0.0 110.839 -176.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.8 ' HB2' HG22 ' A' ' 97' ' ' ILE . 5.1 t -59.22 -47.07 86.69 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.649 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 10.3 ptmm? -64.81 -38.29 90.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.308 -176.07 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.682 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 15.8 mm-40 -65.02 -42.9 93.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.605 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -62.61 -51.41 67.41 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.624 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 58.2 mt -62.39 -54.81 34.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.738 -176.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.644 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 28.5 t-20 -58.18 -45.61 87.22 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.271 0.357 . . . . 0.0 111.843 -174.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.442 HH22 ' HG2' ' A' ' 52' ' ' GLU . 87.0 mtm180 -64.11 -50.18 69.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.838 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -55.64 -47.65 76.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.328 1.061 . . . . 0.0 110.185 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.717 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 3.2 t80 -56.89 -52.14 66.32 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.807 -1.997 . . . . 0.0 112.412 -171.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HE2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -83.46 -23.83 32.06 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.966 -177.017 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.639 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 42.6 m -57.02 -44.14 82.56 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.645 176.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 4.2 mp -63.91 -28.23 69.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.534 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 50.4 mm -71.63 -46.51 62.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 176.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.17 -46.9 81.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.859 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.86 ' HG3' HG23 ' A' ' 30' ' ' VAL . 20.5 ptp180 -85.31 -13.76 48.64 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.93 49.95 5.41 Favored Glycine 0 C--O 1.228 -0.239 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.439 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 1.011 HG13 HG22 ' A' ' 36' ' ' THR . 59.0 t -118.71 3.46 7.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.688 1.232 . . . . 0.0 110.338 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 31' ' ' ASN . 1.0 OUTLIER -96.92 174.49 6.76 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.303 -170.508 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 68.38 9.51 7.3 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.875 0.734 . . . . 0.0 112.018 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.465 ' O ' HG13 ' A' ' 37' ' ' ILE . 41.6 m -136.99 110.15 7.78 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.47 -35.14 75.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.313 -172.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.2 -36.24 74.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.375 0.607 . . . . 0.0 110.361 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 1.011 HG22 HG13 ' A' ' 30' ' ' VAL . 19.1 m -74.16 -39.87 62.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.494 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.501 HG22 HG22 ' A' ' 74' ' ' THR . 78.7 mt -61.37 -34.36 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.36 173.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.91 -50.33 69.15 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.909 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -62.28 -42.15 99.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.708 -176.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.535 ' HG3' HG11 ' A' ' 30' ' ' VAL . 26.9 mm-40 -80.68 -16.78 53.09 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.503 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.59 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.3 tp -68.87 -41.23 78.67 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 172.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 1.7 mp -66.42 -41.44 88.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.46 173.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 32.2 t -64.03 -56.1 17.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.632 ' HA ' ' HB3' ' A' ' 47' ' ' ASP . 22.2 t80 -62.73 -28.78 70.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.223 0.535 . . . . 0.0 109.982 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 42' ' ' ILE . 53.8 t -49.2 -52.28 27.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.628 174.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.6 mt -89.55 -18.37 26.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.776 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.632 ' HB3' ' HA ' ' A' ' 44' ' ' PHE . 27.6 t70 -63.83 -29.16 70.38 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 111.173 -177.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.683 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -73.5 -169.63 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.945 177.132 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -100.37 173.44 6.59 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.365 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -45.56 -41.63 9.51 Favored Glycine 0 C--N 1.332 0.359 0 O-C-N 123.961 0.788 . . . . 0.0 114.453 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -59.45 -53.63 55.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.889 0.345 . . . . 0.0 111.177 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.683 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 2.1 mp0 -75.72 -27.66 58.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.467 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -61.42 -40.46 94.49 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -69.93 -43.42 71.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.197 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.967 HD22 HG12 ' A' ' 13' ' ' VAL . 23.9 tp -55.77 -35.81 66.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.941 178.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.97 -28.14 69.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.084 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -63.88 -31.94 73.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.153 0.501 . . . . 0.0 109.945 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -83.55 -23.21 32.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.357 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.95 -7.69 56.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.987 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.462 ' HA2' ' HB1' ' A' ' 65' ' ' ALA . . . 72.53 43.69 43.61 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.239 -0.891 . . . . 0.0 113.735 171.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.59 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -127.98 23.07 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.499 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -113.02 -117.76 0.31 Allowed 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.092 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.499 ' H ' ' HB ' ' A' ' 62' ' ' THR . 55.7 mtpt -129.05 142.73 50.81 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 60.88 31.42 20.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.723 0.773 . . . . 0.0 109.842 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB1' ' HA2' ' A' ' 60' ' ' GLY . . . -104.23 -178.54 3.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.621 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.508 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -69.39 119.85 14.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.4 p -70.32 -28.02 64.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -72.0 -45.73 59.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.125 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.777 HD11 HD11 ' A' ' 90' ' ' LEU . 14.6 tt -66.03 -28.76 44.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.443 -175.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.463 HD12 HD23 ' A' ' 41' ' ' LEU . 46.5 tp -57.13 -45.53 83.44 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.373 0.606 . . . . 0.0 110.419 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.653 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 17.0 m -71.87 -37.48 70.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.246 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -64.33 -22.9 67.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.967 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 69' ' ' ILE . 94.3 t -86.19 -47.74 16.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.864 174.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.501 HG22 HG22 ' A' ' 37' ' ' ILE . 11.6 p -58.27 -33.64 69.62 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 71' ' ' SER . 5.5 mtt180 -67.29 -55.39 15.55 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.607 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 29.2 Cg_endo -67.34 -16.79 48.86 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.261 1.308 . . . . 0.0 113.01 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.6 mmt -78.2 -14.41 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.641 0.257 . . . . 0.0 111.002 175.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -79.89 -14.73 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.669 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.7 p -150.06 150.09 13.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -176.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.717 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 7.5 t60 -60.9 110.72 1.41 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.182 0.515 . . . . 0.0 110.122 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.669 ' HG3' HG13 ' A' ' 79' ' ' VAL . 48.2 mtp -137.6 173.73 5.11 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.345 -167.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.549 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 2.6 Cg_endo -40.64 0.9 0.0 OUTLIER 'Trans proline' 0 C--O 1.206 -1.081 1 C-N-CA 127.853 5.702 . . . . 0.0 118.863 175.53 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.591 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.41 -32.31 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.809 1.781 . . . . 0.0 115.809 -161.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 1.5 mtm -54.24 -48.05 71.54 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.965 0.888 . . . . 0.0 109.971 171.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 82' ' ' PRO . 3.1 mptp? -70.34 -29.95 66.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.677 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.591 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 50.2 mt -64.71 -29.73 48.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.052 0.453 . . . . 0.0 110.184 -174.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 52.6 t -61.28 -39.75 91.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.307 0.575 . . . . 0.0 109.993 172.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.51 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 15.8 mm-40 -72.05 -22.28 61.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.742 176.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -72.18 -38.87 69.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.777 HD11 HD11 ' A' ' 69' ' ' ILE . 2.8 mm? -66.76 -27.24 67.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.629 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.585 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.0 mmmm -63.51 -23.26 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.866 176.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -77.5 -17.45 57.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.778 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 mp -95.31 -40.87 9.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.608 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -164.32 135.31 4.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.796 0.332 . . . . 0.0 110.695 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.7 m -86.26 -15.48 40.61 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -67.63 -21.67 65.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.246 0.546 . . . . 0.0 110.341 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.8 HG22 ' HB2' ' A' ' 14' ' ' CYS . 57.3 mt -61.87 -23.58 31.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.33 176.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.585 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 24.2 t -89.43 -48.29 7.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.991 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -102.95 21.81 15.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.913 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.95 -42.91 99.65 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.461 ' HD3' ' HA ' ' A' ' 101' ' ' LYS . 60.7 mmtt 63.79 163.3 0.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.55 -1.205 . . . . 0.0 113.883 174.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.789 179.459 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.448 -1.153 0 CA-C-O 121.117 0.382 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.93 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -84.39 -26.18 40.61 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.808 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.598 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . -172.31 -83.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.119 0.485 . . . . 0.0 111.039 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t70 176.02 -27.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 5.4 m -73.09 -147.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.095 169.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . 35.5 tt0 -130.34 -73.84 0.55 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.117 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.932 HG12 HD22 ' A' ' 55' ' ' LEU . 93.8 t -60.48 -47.92 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.498 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.675 ' HA ' HD21 ' A' ' 55' ' ' LEU . 41.9 t -58.56 -37.69 76.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.185 0.517 . . . . 0.0 110.154 174.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.716 ' HG3' ' CA ' ' A' ' 8' ' ' GLY . 27.7 ttpt -64.65 -55.55 19.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.847 -179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 61.9 mm-40 -58.94 -44.89 91.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.898 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -58.02 -56.66 19.18 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.237 0.335 . . . . 0.0 111.717 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 87' ' ' CYS . 97.9 mt -60.1 -48.32 82.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.722 0.296 . . . . 0.0 111.022 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.93 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.0 t-20 -67.06 -41.72 85.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.355 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -78.05 -34.26 50.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.925 -175.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.46 -47.04 87.52 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.825 0.821 . . . . 0.0 109.246 172.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.725 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.6 t80 -56.59 -49.88 73.6 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 113.604 -1.635 . . . . 0.0 111.22 -177.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -71.57 -31.7 67.26 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.319 -179.418 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.506 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 73.1 m -60.16 -38.33 82.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.383 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CG2' ' A' ' 30' ' ' VAL . 4.3 mp -73.73 -22.46 59.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.011 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 46.9 mm -80.35 -43.81 21.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.03 -55.18 35.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.806 174.062 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -78.93 -14.72 59.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.892 -175.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.24 31.66 74.91 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.765 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.662 ' CG2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 m -99.01 3.38 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 122.044 0.926 . . . . 0.0 110.47 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 63.6 t30 -83.62 174.15 10.78 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.093 -169.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.2 t80 75.39 -11.03 1.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.006 0.923 . . . . 0.0 110.795 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 37' ' ' ILE . 24.2 m -100.47 105.41 16.86 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.616 HD21 ' HE ' ' A' ' 75' ' ' ARG . 12.3 tp -62.78 -38.04 89.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.812 -171.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -63.0 -42.04 99.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.401 0.619 . . . . 0.0 110.215 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.7 m -67.27 -38.86 85.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.275 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 33' ' ' SER . 73.9 mt -58.18 -34.17 48.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.724 0.297 . . . . 0.0 110.284 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HG3' ' CD2' ' A' ' 70' ' ' LEU . 35.8 tt0 -69.1 -45.26 70.67 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.463 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -62.94 -40.0 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.195 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.569 ' HG3' HG21 ' A' ' 30' ' ' VAL . 10.0 mm-40 -68.65 -39.39 80.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.309 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.639 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 17.9 mt -55.62 -55.64 29.66 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 120.767 0.318 . . . . 0.0 110.144 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.582 HD11 HD11 ' A' ' 70' ' ' LEU . 1.7 mp -57.47 -46.13 85.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.997 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -61.34 -51.09 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.491 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -61.88 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.068 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.8 m -65.4 -28.59 69.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.521 -178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -86.62 -49.26 7.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -82.32 63.8 6.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.424 0.631 . . . . 0.0 111.067 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.401 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -150.92 -161.45 1.34 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.693 178.644 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HG2' ' OE1' ' A' ' 52' ' ' GLU . 13.2 pttm -103.18 166.86 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 121.081 -0.248 . . . . 0.0 111.241 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.36 -43.48 26.96 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 124.068 0.855 . . . . 0.0 114.398 -170.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.811 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.0 mptt -58.37 -47.69 83.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.234 0.517 . . . . 0.0 111.249 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.408 ' OE1' ' HG2' ' A' ' 49' ' ' LYS . 40.7 mt-10 -71.82 -41.08 68.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.507 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 -58.09 -44.18 87.49 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -70.01 -41.86 73.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.871 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.932 HD22 HG12 ' A' ' 13' ' ' VAL . 23.5 tp -53.62 -42.78 68.09 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.691 -177.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 86.2 m -67.34 -14.13 62.64 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -72.31 -25.73 61.68 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.543 ' HB3' HG12 ' A' ' 97' ' ' ILE . 77.0 m-85 -84.99 -40.25 17.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.75 175.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 82.5 mt -74.08 -18.8 60.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.39 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.05 -13.5 63.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.293 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -85.59 75.44 10.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.21 0.529 . . . . 0.0 111.582 -176.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.582 HG22 ' H ' ' A' ' 63' ' ' LYS . 5.8 m -152.78 176.77 11.43 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.582 ' H ' HG22 ' A' ' 62' ' ' THR . 29.4 mtpp -63.17 -37.69 88.21 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.63 -152.69 0.32 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.201 -0.908 . . . . 0.0 109.21 174.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.52 -164.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 112.201 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.75 126.8 34.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.567 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.4 p -86.18 -21.16 27.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.993 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -81.28 -44.92 17.01 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.361 -175.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.485 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 13.9 tt -63.33 -24.61 36.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.428 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 42' ' ' ILE . 3.3 tt -60.14 -44.25 95.09 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 174.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.646 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 19.0 m -66.51 -18.87 65.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.01 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 27.8 mm-40 -71.62 -56.08 6.53 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.28 -45.25 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.41 0.444 . . . . 0.0 111.921 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.4 p -55.24 -34.28 63.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.646 ' HD3' ' O ' ' A' ' 71' ' ' SER . 3.1 mpt_? -66.5 -56.45 15.32 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.86 -173.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.681 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 25.8 Cg_endo -65.61 -30.13 51.58 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.624 1.549 . . . . 0.0 112.977 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.2 mmt -67.79 -14.13 62.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.16 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -78.35 -15.27 58.88 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.451 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.569 HG23 ' HG3' ' A' ' 81' ' ' MET . 4.0 m -144.23 -169.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.933 0.397 . . . . 0.0 111.386 -174.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.725 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 58.1 t60 -89.57 99.44 12.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.681 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 38.9 mtp -136.34 169.67 12.89 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -170.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.562 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.1 Cg_endo -42.44 -0.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.935 1 C-N-CA 127.809 5.672 . . . . 0.0 118.128 177.624 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.646 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.82 -35.07 0.08 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -159.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.65 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -65.72 -51.65 57.58 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 118.664 0.665 . . . . 0.0 110.513 177.014 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.637 ' H ' ' HG2' ' A' ' 84' ' ' MET . 42.7 mtmt -67.21 -19.49 65.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.711 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.646 HD12 ' HA ' ' A' ' 83' ' ' ALA . 27.9 mt -63.86 -28.97 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.912 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.598 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 49.3 t -68.84 -35.07 76.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.717 176.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.872 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 67.7 mm-40 -68.21 -28.54 67.34 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.792 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.498 ' CD ' ' HA ' ' A' ' 86' ' ' ILE . 31.7 mttm -74.72 -40.14 61.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.24 177.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 92.3 mt -68.35 -25.21 64.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.183 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.872 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 58.2 mtpt -61.24 -21.24 63.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.526 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -76.18 -22.16 55.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.099 0.476 . . . . 0.0 110.386 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.2 -53.23 4.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.43 ' OD1' HG13 ' A' ' 97' ' ' ILE . 10.8 t70 -138.18 115.01 10.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.423 177.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.1 m -82.62 -15.01 53.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.792 0.33 . . . . 0.0 111.336 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.426 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 2.1 mp0 -65.74 -34.86 79.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.919 -177.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.543 HG12 ' HB3' ' A' ' 58' ' ' TYR . 78.3 mt -48.04 -42.0 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.47 176.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.623 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 35.9 t -72.68 -42.27 64.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.885 -173.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -81.31 14.5 2.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.67 116.03 21.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 170.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HD3' ' HB3' ' A' ' 12' ' ' GLU . 32.4 mmtp -116.58 149.65 39.31 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.811 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 98.9 m-85 . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 177.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo . . . . . 0 N--CA 1.446 -1.293 0 CA-C-O 121.027 0.345 . . . . 0.0 111.605 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.674 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -96.71 -19.73 26.3 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.439 -176.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.779 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . 173.21 -153.08 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.208 0.603 . . . . 0.0 109.725 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -121.39 -36.67 3.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.641 0.258 . . . . 0.0 110.354 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 42.3 m -56.36 -81.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.869 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 15' ' ' LYS . 7.3 tp10 170.41 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.727 0.299 . . . . 0.0 111.627 172.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.667 HG12 HD22 ' A' ' 55' ' ' LEU . 53.5 t -64.59 -38.16 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.477 -172.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 21.7 p -60.24 -30.71 69.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 174.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -72.18 -41.65 66.75 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.219 -175.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' HH11 ' A' ' 20' ' ' ARG . 43.6 mm-40 -56.23 -48.47 76.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.667 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -61.55 -54.98 35.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.144 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 96.0 mt -59.57 -48.16 82.76 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.502 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.7 t-20 -68.5 -44.75 74.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.466 HH11 ' HB3' ' A' ' 16' ' ' GLU . 30.7 mtp180 -64.63 -39.19 93.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.687 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 76.2 t80 -62.69 -50.24 71.92 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.954 0.883 . . . . 0.0 109.684 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.544 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 29.9 t80 -47.37 -55.06 9.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.84 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.627 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -68.74 -37.74 79.64 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.204 -179.303 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.627 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 27.2 t -59.23 -33.18 70.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.388 0.613 . . . . 0.0 110.758 -175.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.587 ' HA ' HG13 ' A' ' 30' ' ' VAL . 2.9 mp -83.04 -46.69 12.54 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.573 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 28.8 mm -67.34 -37.78 79.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.176 0.513 . . . . 0.0 110.225 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -72.28 -46.07 57.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.407 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.964 ' HG2' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -82.08 -14.15 56.24 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.031 0.443 . . . . 0.0 110.75 -177.028 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.58 1.78 60.28 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.061 172.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.964 HG12 ' HG2' ' A' ' 28' ' ' ARG . 1.9 p -87.94 99.02 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.568 ' HA ' HD11 ' A' ' 37' ' ' ILE . 7.5 t-20 -165.73 -176.96 4.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.969 -0.457 . . . . 0.0 111.253 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 62.5 38.57 12.51 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.35 0.66 . . . . 0.0 111.54 -177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.599 ' O ' HG12 ' A' ' 37' ' ' ILE . 55.5 m -157.8 104.94 1.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.913 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.4 mm? -58.95 -43.68 91.29 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -172.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.46 -38.25 83.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.25 0.548 . . . . 0.0 110.715 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.409 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 48.1 m -73.6 -40.82 63.55 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.333 -178.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 33' ' ' SER . 35.9 mm -58.58 -37.61 65.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -69.46 -44.26 71.58 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 32.3 mmtm -77.0 -18.8 57.96 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.925 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.592 ' HG3' HG21 ' A' ' 30' ' ' VAL . 62.1 mm-40 -85.35 -28.02 25.48 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.933 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HD21 ' A' ' 70' ' ' LEU . 13.2 mt -59.71 -55.46 34.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 168.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.44 HD12 ' HD3' ' A' ' 39' ' ' LYS . 60.4 mt -53.63 -43.85 55.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.069 176.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -63.85 -48.1 78.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.905 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -68.55 -32.92 73.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.854 0.359 . . . . 0.0 110.595 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 91.3 m -66.07 -22.62 66.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.946 0.403 . . . . 0.0 110.872 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.8 tp -87.64 -41.57 13.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.104 172.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -79.17 48.35 0.86 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.731 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -142.05 -172.65 3.62 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.521 177.773 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -97.56 173.46 7.14 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.58 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.51 -43.25 58.59 Favored Glycine 0 C--N 1.33 0.224 0 O-C-N 123.548 0.53 . . . . 0.0 114.022 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.7 tppt? -61.14 -42.25 98.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.135 0.493 . . . . 0.0 110.153 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 20.6 mt-10 -78.27 -37.56 44.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.766 -176.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -57.54 -40.57 79.12 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -78.96 -36.38 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.633 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.667 HD22 HG12 ' A' ' 13' ' ' VAL . 38.3 tp -53.63 -34.62 59.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.569 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 9.2 t -68.12 -15.35 63.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -74.56 -21.09 59.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.292 0.568 . . . . 0.0 109.964 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.551 ' HB3' HG12 ' A' ' 97' ' ' ILE . 98.7 m-85 -86.12 -34.56 20.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.008 174.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.78 -36.11 67.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.503 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.56 -3.76 34.6 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 121.057 -0.592 . . . . 0.0 113.862 172.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 70' ' ' LEU . . . -92.44 53.22 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -173.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -126.07 -84.94 0.62 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.058 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 62' ' ' THR . 27.5 mtpp -146.09 -70.21 0.26 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.138 0.494 . . . . 0.0 110.067 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -126.59 101.62 6.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.958 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -161.18 -79.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.753 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -148.41 60.99 1.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.308 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -68.65 -19.22 64.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.536 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -81.51 -27.28 34.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.026 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.517 ' HB ' HD23 ' A' ' 93' ' ' LEU . 6.7 pt -86.11 -18.93 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-O 121.368 0.604 . . . . 0.0 109.547 175.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 61' ' ' ALA . 2.7 tm? -65.72 -26.85 67.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.712 -173.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.668 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 2.6 m -60.32 -27.85 67.67 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.322 0.582 . . . . 0.0 110.698 178.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.65 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 8.8 tp10 -72.2 -14.69 61.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.406 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.574 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 58.1 t -87.91 -53.22 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.008 0.432 . . . . 0.0 110.484 172.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -55.48 -53.08 60.78 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -172.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.668 ' HD3' ' O ' ' A' ' 71' ' ' SER . 1.5 mtp-105 -58.48 -51.73 79.72 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.686 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.731 ' HB3' ' SD ' ' A' ' 81' ' ' MET . 47.9 Cg_exo -61.52 -39.43 55.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.565 1.51 . . . . 0.0 113.361 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.492 ' HG3' ' HE2' ' A' ' 21' ' ' PHE . 23.8 mmt -61.81 -16.68 51.91 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.882 0.372 . . . . 0.0 111.281 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.567 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 40.6 t -75.31 -11.76 60.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.572 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -136.95 168.67 21.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -71.02 96.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.822 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -118.12 158.78 45.41 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.854 -163.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.822 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 25.0 Cg_exo -40.55 3.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.745 1 C-N-CA 127.831 5.687 . . . . 0.0 118.034 167.618 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.91 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -163.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.674 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -64.51 -48.56 74.7 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.955 1.252 . . . . 0.0 109.583 173.116 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 34.8 ttmt -66.29 -20.7 66.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.198 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 83' ' ' ALA . 44.8 mt -66.22 -30.85 51.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.059 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 90' ' ' LEU . 50.0 t -78.46 -20.34 51.15 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.887 176.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.592 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 4.8 tp10 -64.34 -50.75 66.55 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 46.8 mtmt -63.17 -33.25 75.06 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.515 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 13.3 mt -61.87 -21.86 65.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.677 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.647 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 26.7 mtmm -64.61 -24.03 67.46 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.964 -176.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 92' ' ' LYS . 24.6 tptp -79.78 -19.09 49.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.205 0.526 . . . . 0.0 110.254 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.8 mp -85.87 -48.16 9.0 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -160.44 122.61 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.992 174.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -84.37 -14.01 50.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.007 0.432 . . . . 0.0 110.959 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -75.28 -14.29 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.551 HG12 ' HB3' ' A' ' 58' ' ' TYR . 83.3 mt -60.61 -33.05 53.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 122.001 0.905 . . . . 0.0 109.181 170.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.647 ' SG ' ' HG2' ' A' ' 91' ' ' LYS . 90.9 m -87.67 -51.4 5.9 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.597 -177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.09 43.94 1.04 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.195 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.556 ' O ' HG21 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -111.53 48.76 0.93 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -62.01 158.04 17.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.395 -172.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.464 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 71.2 m-85 . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.952 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 N--CA 1.46 -0.49 0 N-CA-C 111.01 -0.419 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.958 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -66.77 -41.2 93.79 Favored Glycine 0 N--CA 1.439 -1.132 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.525 -169.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.615 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -179.51 -82.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.545 0.688 . . . . 0.0 110.953 -173.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -165.21 -70.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.635 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 p -68.33 128.92 38.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.429 175.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.673 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 34.2 mp0 -48.26 -76.92 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.84 HG12 HD22 ' A' ' 55' ' ' LEU . 59.3 t -51.73 -42.47 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.3 t -63.87 -46.23 85.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.073 0.463 . . . . 0.0 110.27 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.1 ptmt -68.96 -36.52 78.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.435 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.1 mm-40 -61.84 -51.38 68.47 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.096 -178.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -65.01 -54.51 29.29 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.334 -176.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.568 HD12 ' SG ' ' A' ' 87' ' ' CYS . 71.3 mt -58.08 -52.95 63.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -174.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.958 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -68.54 -36.2 78.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.937 0.399 . . . . 0.0 111.309 -175.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.2 ttm180 -73.68 -39.12 64.63 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.33 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.535 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 87.3 t80 -61.84 -49.37 76.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.589 0.709 . . . . 0.0 109.241 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.455 ' O ' HG12 ' A' ' 26' ' ' ILE . 40.8 t80 -48.86 -47.89 42.41 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.05 178.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -77.57 -46.93 20.75 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.6 t -57.7 -29.03 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.092 0.473 . . . . 0.0 110.683 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 3.9 tp -72.03 -41.61 67.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.446 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 22' ' ' TYR . 40.7 mm -68.66 -36.67 75.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.488 0.661 . . . . 0.0 109.637 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.39 -45.67 86.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.387 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 28' ' ' ARG . 18.1 mtp180 -70.19 -26.1 63.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.404 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.95 12.44 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.564 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.672 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.41 126.7 71.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 114.749 -0.725 . . . . 0.0 109.339 -178.464 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.537 ' O ' HD11 ' A' ' 37' ' ' ILE . 63.3 t30 -173.91 -45.18 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 175.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -79.54 47.36 0.82 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.335 0.588 . . . . 0.0 111.784 -173.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 37' ' ' ILE . 20.4 m -157.88 109.56 2.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.825 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.569 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.9 mm? -57.88 -41.64 82.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.977 -176.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -59.09 -41.95 89.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.232 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -70.72 -42.65 70.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.514 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.537 HD11 ' O ' ' A' ' 31' ' ' ASN . 67.3 mt -57.69 -37.39 59.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -71.16 -47.24 58.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.086 -178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.676 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -60.97 -43.38 98.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.482 ' HG3' HG21 ' A' ' 30' ' ' VAL . 4.8 mm-40 -78.55 -27.04 45.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -176.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.535 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 6.2 mt -59.28 -48.83 80.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.51 -47.27 85.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.67 175.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.5 m -60.05 -47.28 86.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.299 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -71.09 -38.51 72.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.48 -175.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.452 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 54.5 m -66.62 -28.65 68.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -86.02 -20.14 29.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.093 0.473 . . . . 0.0 110.641 176.216 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -87.47 -24.64 24.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.314 -175.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -70.13 -173.76 0.72 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.846 -179.445 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -96.34 174.36 6.91 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.284 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.01 -47.86 39.68 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 114.758 0.663 . . . . 0.0 114.758 -169.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -61.2 -36.35 79.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.258 0.529 . . . . 0.0 111.371 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.0 mt-10 -80.67 -38.75 28.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.094 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -58.1 -47.32 83.61 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -64.35 -38.5 91.25 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.735 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.84 HD22 HG12 ' A' ' 13' ' ' VAL . 34.1 tp -57.88 -36.87 72.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.5 m -70.92 -17.39 62.69 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.72 -29.7 67.16 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -86.17 -38.61 17.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.36 177.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.1 mt -73.22 -25.88 60.91 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.571 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.618 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.12 -9.52 42.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.487 174.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -81.78 55.85 2.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.724 0.773 . . . . 0.0 111.118 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 64' ' ' ASP . 24.8 m -156.82 140.71 16.19 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -75.68 19.72 0.19 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.039 0.447 . . . . 0.0 112.023 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 62' ' ' THR . 1.2 m-20 -127.16 1.93 6.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.886 176.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.92 -174.16 2.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.775 -172.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.421 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -67.66 136.51 54.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.961 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 p -84.41 -35.52 23.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.854 -175.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -72.88 -22.49 60.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.07 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.618 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.1 tt -85.67 -24.92 6.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.256 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.614 HD13 ' HA ' ' A' ' 61' ' ' ALA . 21.2 tp -61.5 -43.55 98.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.439 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 16.0 p -68.57 -23.01 64.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -75.89 -19.94 58.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.652 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.44 ' O ' ' HG2' ' A' ' 77' ' ' MET . 48.3 t -88.73 -52.09 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.282 172.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.511 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 18.4 p -55.27 -49.45 72.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.604 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.0 mpt_? -55.46 -54.59 49.41 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -176.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.459 ' HB3' ' HE2' ' A' ' 81' ' ' MET . 27.7 Cg_endo -66.49 -13.27 39.22 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.898 1.732 . . . . 0.0 114.41 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 24.4 mmt -77.25 -25.38 51.47 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.087 176.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 t -73.63 -13.97 61.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.202 -175.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.37 163.53 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.42 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 75.2 t60 -70.14 89.28 0.63 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.36 0.527 . . . . 0.0 110.201 178.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.496 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 5.3 mtp -110.29 176.86 1.37 Allowed Pre-proline 0 C--N 1.318 -0.767 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.337 -176.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.545 ' O ' HG13 ' A' ' 86' ' ' ILE . 33.1 Cg_exo -42.69 -0.17 0.01 OUTLIER 'Trans proline' 0 C--O 1.212 -0.801 1 C-N-CA 126.113 4.542 . . . . 0.0 116.904 171.162 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.748 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.55 -41.07 0.64 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.133 1.333 . . . . 0.0 114.052 -169.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.696 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -61.98 -56.87 14.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.043 0.925 . . . . 0.0 109.543 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 39.3 ttmt -62.07 -14.53 37.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.232 178.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 83' ' ' ALA . 42.0 mt -70.51 -26.01 27.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 O-C-N 122.037 -0.414 . . . . 0.0 111.3 -177.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.568 ' SG ' HD12 ' A' ' 18' ' ' LEU . 84.8 m -73.05 -17.48 61.42 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.816 0.817 . . . . 0.0 110.213 173.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.9 mt-10 -85.94 -45.34 11.59 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.187 171.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 86' ' ' ILE . 26.4 ttpp -64.06 -38.18 90.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.384 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.19 -14.48 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -66.82 -14.92 63.21 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.953 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -67.36 -29.13 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.463 0.649 . . . . 0.0 109.56 173.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.6 mp -94.23 -47.41 6.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.109 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.411 ' OD2' HG13 ' A' ' 97' ' ' ILE . 23.4 t70 -161.27 124.15 3.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.022 -179.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.4 p -86.82 -16.16 37.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.739 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.666 ' HA ' ' HG2' ' A' ' 99' ' ' GLU . 1.9 mp0 -72.15 -19.67 61.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.717 0.294 . . . . 0.0 111.346 -175.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.411 HG13 ' OD2' ' A' ' 94' ' ' ASP . 71.3 mt -54.66 -30.8 22.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.332 0.587 . . . . 0.0 110.585 174.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 13.3 m -82.45 -24.76 34.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.592 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.666 ' HG2' ' HA ' ' A' ' 96' ' ' GLN . 11.8 pt-20 -100.6 20.65 14.69 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.45 -63.6 1.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt 66.19 131.7 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.748 177.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.278 179.689 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo . . . . . 0 N--CA 1.444 -1.389 0 CA-C-O 120.793 0.247 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.771 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -88.09 -23.17 38.89 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.883 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.534 ' N ' ' HG2' ' A' ' 15' ' ' LYS . . . 172.92 -129.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.33 -0.935 . . . . 0.0 108.487 -175.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -139.3 -33.38 0.62 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 169.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.618 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 26.5 m -60.38 106.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.976 167.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -48.88 -69.52 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -165.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.546 HG11 ' HB2' ' A' ' 100' ' ' LEU . 14.3 p -59.46 -31.37 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.613 0.721 . . . . 0.0 110.52 -174.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 11' ' ' CYS . 51.2 t -69.88 -35.81 74.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.371 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 11' ' ' CYS . 55.9 mtpt -57.04 -53.79 54.05 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.266 0.555 . . . . 0.0 109.915 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.534 ' HB3' HH11 ' A' ' 20' ' ' ARG . 13.5 mm-40 -53.7 -51.78 62.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.318 -177.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.663 ' HE2' ' HA ' ' A' ' 45' ' ' CYS . 43.6 t80 -61.4 -55.44 31.38 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.86 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.95 -49.41 77.55 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -174.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.771 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 14.6 t30 -68.56 -46.8 68.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.354 -174.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.534 HH11 ' HB3' ' A' ' 16' ' ' GLU . 46.2 mtp180 -63.18 -41.27 99.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.114 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.03 -48.67 80.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.622 0.725 . . . . 0.0 109.827 175.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.664 ' HE2' ' H ' ' A' ' 81' ' ' MET . 47.9 t80 -51.91 -55.85 17.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.201 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -73.51 -30.23 62.99 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.329 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.602 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 71.9 m -64.62 -45.85 85.13 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 121.205 -0.198 . . . . 0.0 110.47 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.2 mp -63.46 -41.41 98.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.588 0.233 . . . . 0.0 111.36 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.533 HG12 ' O ' ' A' ' 22' ' ' TYR . 39.7 mm -67.23 -40.03 84.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.057 0.456 . . . . 0.0 110.278 177.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.57 -44.94 73.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.148 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 28' ' ' ARG . 10.2 mtp180 -72.04 -15.26 62.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.1 39.43 27.39 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.628 HG21 ' HG3' ' A' ' 40' ' ' GLU . 0.7 OUTLIER -130.92 98.76 3.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.204 0.526 . . . . 0.0 110.123 -177.474 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.49 -177.83 3.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.057 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 57.3 31.98 21.01 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.289 0.566 . . . . 0.0 111.515 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.588 ' O ' HG12 ' A' ' 37' ' ' ILE . 62.8 m -150.75 107.56 3.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 176.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.706 HD13 ' HE ' ' A' ' 75' ' ' ARG . 95.1 mt -60.09 -41.64 92.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.391 -170.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -67.59 -28.94 68.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.257 0.551 . . . . 0.0 109.874 -178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 m -78.14 -37.5 45.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.859 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 33' ' ' SER . 17.0 mm -64.6 -32.54 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.476 ' CG ' HG21 ' A' ' 74' ' ' THR . 41.1 mt-10 -66.01 -23.68 66.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.694 178.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -85.77 -52.48 5.74 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.147 0.498 . . . . 0.0 110.382 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.628 ' HG3' HG21 ' A' ' 30' ' ' VAL . 7.1 mm-40 -71.64 -25.9 62.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.46 -171.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 7.3 mt -58.45 -38.38 77.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 171.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.1 mt -74.71 -45.96 43.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.144 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 m -57.58 -45.21 85.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.177 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -78.3 -32.93 49.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.954 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.663 ' HA ' ' HE2' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -73.06 -19.41 61.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.342 0.591 . . . . 0.0 110.14 -179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.0 tp -86.35 -41.23 14.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.044 170.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.73 63.61 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.661 0.743 . . . . 0.0 110.492 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.742 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -158.71 -172.42 3.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.595 -179.146 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -98.71 171.49 8.07 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.061 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.69 -43.88 38.12 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 123.644 0.59 . . . . 0.0 114.573 -171.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 7.7 tptp -63.09 -35.36 80.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.312 0.577 . . . . 0.0 110.681 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.742 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 16.0 mt-10 -85.48 -36.43 20.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.242 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.578 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 81.6 m-20 -61.39 -39.06 89.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.552 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 19.7 tpt180 -75.08 -35.72 61.79 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.1 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD13 HD12 ' A' ' 100' ' ' LEU . 49.6 tp -58.66 -25.18 62.51 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.333 0.587 . . . . 0.0 110.361 175.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 53' ' ' ASN . 13.2 t -62.29 -32.38 73.09 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.391 176.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -74.91 -17.92 60.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 0.0 109.807 177.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.68 ' HB3' HG12 ' A' ' 97' ' ' ILE . 84.8 m-85 -86.08 -55.13 4.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.904 176.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.8 -18.36 65.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.642 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 82.64 36.13 17.37 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.416 175.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.404 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -93.63 16.87 12.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.215 0.531 . . . . 0.0 110.587 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.489 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -132.91 128.58 36.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.468 178.097 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 67' ' ' THR . 54.9 mtpt -76.91 -10.3 59.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.182 0.515 . . . . 0.0 110.262 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -74.86 -14.82 60.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.039 174.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.29 -139.65 0.32 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.872 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.63 102.04 0.06 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.158 0.504 . . . . 0.0 109.93 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.469 HG23 ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -86.39 -37.84 17.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.149 -169.298 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -72.28 -35.96 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.511 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.642 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.3 tt -64.12 -23.85 34.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.266 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.97 -49.95 70.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.462 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 8.0 m -66.48 -27.19 67.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.753 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -75.29 -21.51 58.44 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.064 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.537 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.0 t -87.21 -41.91 14.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.943 173.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.476 HG21 ' CG ' ' A' ' 38' ' ' GLU . 39.7 p -60.68 -42.03 96.3 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.706 ' HE ' HD13 ' A' ' 34' ' ' LEU . 4.3 mpt_? -55.69 -53.47 62.36 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.517 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.537 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 31.8 Cg_exo -62.52 -45.78 13.56 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.865 1.71 . . . . 0.0 112.828 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 14.3 mmt -62.78 -14.81 49.5 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB2' HD23 ' A' ' 34' ' ' LEU . 40.4 t -66.79 -14.45 62.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.423 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.02 162.26 34.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -61.63 107.1 0.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 175.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.843 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -119.68 153.42 54.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -163.166 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.843 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 24.9 Cg_exo -40.56 3.48 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.952 1 C-N-CA 127.923 5.749 . . . . 0.0 117.919 167.183 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.729 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.59 -31.7 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 115.618 1.71 . . . . 0.0 115.618 -164.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.496 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -50.93 -49.32 60.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.462 0.648 . . . . 0.0 110.257 173.158 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 18.0 ptpt -85.81 -15.16 42.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.474 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.808 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 15.2 mt -59.39 -42.67 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HD12 ' A' ' 90' ' ' LEU . 19.4 t -67.32 -22.07 65.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.286 0.565 . . . . 0.0 111.102 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 15.5 tp10 -76.41 -44.16 37.25 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.808 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 10.1 mtmp? -61.11 -24.96 66.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.17 176.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 87' ' ' CYS . 23.1 mt -66.75 -17.82 65.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.264 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -63.53 -20.62 65.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.782 0.325 . . . . 0.0 110.806 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -69.04 -29.51 67.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.181 0.515 . . . . 0.0 110.333 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.56 -59.49 2.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.321 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -151.33 134.2 15.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.345 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.9 m -85.24 -19.55 31.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.465 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -68.07 -30.87 70.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.894 0.378 . . . . 0.0 110.668 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.68 HG12 ' HB3' ' A' ' 58' ' ' TYR . 20.2 mt -56.55 -33.55 39.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.234 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.609 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 53.7 t -75.04 -35.98 61.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.748 -174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -85.99 -107.92 0.05 Allowed 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.298 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 55' ' ' LEU . 73.7 mt 64.39 -69.45 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.888 0.475 . . . . 0.0 111.059 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 70.2 149.25 0.08 Allowed 'General case' 0 C--O 1.231 0.119 0 O-C-N 123.931 0.769 . . . . 0.0 110.836 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.357 174.125 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.444 -1.436 0 N-CA-C 111.226 -0.336 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.599 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -76.14 -29.94 57.91 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 119.065 -1.541 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.467 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.43 -94.08 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.481 -0.86 . . . . 0.0 109.201 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.444 ' HB3' ' CD ' ' A' ' 88' ' ' GLU . 19.3 t70 -164.25 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 170.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 92.5 m -59.8 166.72 2.47 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.402 166.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 40.2 tt0 -89.77 -77.73 0.38 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -167.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.852 HG12 HD22 ' A' ' 55' ' ' LEU . 59.6 t -55.04 -42.57 65.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.289 0.566 . . . . 0.0 111.322 -170.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.673 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.8 t -63.51 -36.0 82.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.73 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 16' ' ' GLU . 2.5 ptpp? -69.25 -35.61 76.29 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.68 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.528 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 61.7 mm-40 -56.88 -55.15 38.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.628 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -57.42 -55.04 39.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.821 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.577 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.0 mt -61.5 -38.84 88.78 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.048 -173.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -64.45 -55.36 21.39 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.17 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.57 -55.56 24.6 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.24 -50.71 61.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.529 0.68 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.586 ' O ' HG12 ' A' ' 26' ' ' ILE . 54.9 t80 -53.79 -55.27 27.95 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 113.998 -1.456 . . . . 0.0 111.257 -178.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.95 -34.02 59.84 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.527 -176.233 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 75.2 m -58.29 -46.26 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.664 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.605 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 2.4 mp -66.33 -44.91 81.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.072 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 22' ' ' TYR . 48.6 mm -59.88 -38.69 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.608 177.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -64.1 -39.38 93.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.864 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB3' HG23 ' A' ' 30' ' ' VAL . 32.6 mtm180 -83.23 -14.85 52.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.115 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.0 15.35 62.99 Favored Glycine 0 N--CA 1.453 -0.177 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.605 ' HB ' ' HG ' ' A' ' 25' ' ' LEU . 43.7 t -93.74 106.0 17.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 114.245 -0.978 . . . . 0.0 110.043 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.758 ' HA ' HD11 ' A' ' 37' ' ' ILE . 1.0 OUTLIER -164.43 -55.26 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 118.499 -1.28 . . . . 0.0 114.212 176.576 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -78.74 59.04 2.43 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.637 0.732 . . . . 0.0 110.575 -174.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.8 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 13.5 m -157.95 101.65 1.79 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.063 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.45 -46.74 76.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.807 -176.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.93 -30.68 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.279 0.561 . . . . 0.0 110.47 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.8 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 51.6 m -76.02 -46.33 29.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.498 -177.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.758 HD11 ' HA ' ' A' ' 31' ' ' ASN . 32.3 mm -58.52 -33.8 49.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -63.27 -50.71 69.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.884 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -65.21 -39.0 92.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.357 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.509 ' HG3' HG11 ' A' ' 30' ' ' VAL . 53.6 mm-40 -70.19 -40.64 74.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.299 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.566 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 16.8 mt -55.5 -55.54 30.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 59.2 mt -54.76 -47.43 74.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.429 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.4 m -63.93 -51.27 65.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.503 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -67.05 -35.37 79.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.052 0.453 . . . . 0.0 110.353 -176.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.97 -33.63 75.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.243 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.1 mm? -87.63 -20.73 25.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.904 0.383 . . . . 0.0 111.419 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.68 -31.57 61.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.062 0.458 . . . . 0.0 111.262 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.769 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -69.66 -170.42 0.3 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.876 -178.255 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -95.82 171.18 8.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.113 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -42.68 43.63 Favored Glycine 0 N--CA 1.453 -0.205 0 O-C-N 123.687 0.617 . . . . 0.0 114.408 -169.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 14.8 tptt -61.81 -39.27 91.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.519 0.676 . . . . 0.0 110.317 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.769 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.0 mt-10 -80.81 -35.99 32.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.36 -175.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -63.42 -43.41 97.58 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.573 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 12.6 tpt180 -63.12 -37.38 86.97 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.661 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.852 HD22 HG12 ' A' ' 13' ' ' VAL . 61.6 tp -56.18 -45.09 79.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.633 176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 57.3 m -71.01 -14.52 62.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.067 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 9.9 m-85 -65.45 -32.21 73.71 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 172.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.544 ' HB3' HG12 ' A' ' 97' ' ' ILE . 91.1 m-85 -85.74 -39.11 17.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.267 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 95.8 mt -66.84 -19.84 65.81 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.891 177.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.558 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 86.79 12.12 69.46 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.023 174.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -98.55 19.12 15.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.064 0.459 . . . . 0.0 111.894 -174.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.1 p -102.06 160.51 14.45 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -75.74 -4.7 41.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -168.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -124.4 19.55 8.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.12 0.486 . . . . 0.0 110.318 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.74 -178.3 3.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.775 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.69 119.39 18.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.59 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.5 p -74.06 -17.3 60.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.771 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -58.46 -50.5 73.51 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.558 HG23 ' HA3' ' A' ' 60' ' ' GLY . 12.9 tt -75.44 -31.08 23.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.184 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.0 tt -56.3 -55.16 36.82 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.469 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 8.1 p -67.03 -29.62 69.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.072 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.48 -22.74 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.03 0.443 . . . . 0.0 110.41 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.675 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 98.1 t -85.81 -48.81 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.484 175.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 37' ' ' ILE . 41.3 p -61.01 -36.91 80.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 71' ' ' SER . 2.1 mpp_? -54.47 -56.07 30.73 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.546 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.675 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 11.8 Cg_exo -71.67 -36.72 6.1 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.579 1.52 . . . . 0.0 112.436 174.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.449 ' HB2' ' HA ' ' A' ' 74' ' ' THR . 3.8 mmt -59.46 -20.52 55.77 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -60.8 -13.64 16.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.3 m -126.45 174.74 9.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -64.89 88.21 0.06 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.807 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 14.1 tpt -103.28 149.58 37.1 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -162.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.807 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 23.4 Cg_exo -41.41 3.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 127.771 5.647 . . . . 0.0 117.978 168.355 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.523 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.44 -27.52 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -165.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.599 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -53.12 -49.0 67.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.808 0.813 . . . . 0.0 109.476 171.615 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE3' ' HB3' ' A' ' 82' ' ' PRO . 41.1 mtmt -74.01 -30.41 62.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.315 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.551 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 39.6 mt -60.53 -41.44 87.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.942 -174.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.577 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 43.9 t -63.07 -33.0 74.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.318 0.58 . . . . 0.0 110.93 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.444 ' CD ' ' HB3' ' A' ' 10' ' ' ASP . 69.6 mm-40 -74.81 -36.07 62.47 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.119 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.18 -28.24 66.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.015 175.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.449 ' HA ' HD13 ' A' ' 93' ' ' LEU . 28.8 mt -71.04 -15.77 62.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.302 177.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -69.8 -16.12 63.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 0.0 110.334 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -68.92 -24.95 64.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.6 176.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 90' ' ' LEU . 7.0 mp -80.91 -53.53 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.719 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HB3' HG13 ' A' ' 97' ' ' ILE . 24.2 t70 -164.66 143.16 6.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.846 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.2 p -79.34 -22.75 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -173.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -73.12 -20.29 60.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.544 HG12 ' HB3' ' A' ' 58' ' ' TYR . 10.1 mt -62.97 -33.1 58.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.177 -178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 14' ' ' CYS . 12.4 p -104.63 -28.45 11.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.855 0.36 . . . . 0.0 110.935 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -76.12 -94.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.169 -171.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 25.3 mt 65.71 -63.56 0.21 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.807 0.692 . . . . 0.0 111.948 -177.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 71.01 123.59 0.03 OUTLIER 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.658 0.783 . . . . 0.0 111.192 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.775 176.116 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.447 -1.216 0 CA-C-O 121.077 0.365 . . . . 0.0 111.512 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.765 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -65.73 -34.11 87.89 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.456 -0.878 . . . . 0.0 110.931 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -176.01 -136.64 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.228 -0.986 . . . . 0.0 108.638 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -121.8 -52.62 2.0 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.633 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 3.1 m -54.8 95.42 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.221 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.522 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 42.0 tp10 -41.14 -58.0 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -168.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.873 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -60.49 -52.36 62.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.131 0.491 . . . . 0.0 111.191 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HA ' HD21 ' A' ' 55' ' ' LEU . 3.0 t -62.49 -35.73 80.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.495 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.563 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 3.3 ttmt -56.46 -52.74 63.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.795 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.5 ' N ' ' HG2' ' A' ' 15' ' ' LYS . 55.2 mm-40 -56.57 -48.94 76.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.628 178.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -57.37 -50.44 72.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.747 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.862 HD11 ' HB2' ' A' ' 87' ' ' CYS . 98.0 mt -58.83 -55.93 28.72 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -175.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.765 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -66.23 -39.86 89.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.684 0.278 . . . . 0.0 111.311 -171.01 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 -68.05 -36.38 79.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.697 0.284 . . . . 0.0 110.557 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.94 -46.45 68.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.805 0.812 . . . . 0.0 109.427 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.465 ' O ' HG12 ' A' ' 26' ' ' ILE . 86.1 t80 -48.48 -52.88 20.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.521 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.631 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -74.4 -36.38 63.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.631 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 72.2 m -63.73 -31.81 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 25' ' ' LEU . 1.1 tp -75.84 -24.01 55.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.768 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 22' ' ' TYR . 45.2 mm -84.07 -37.09 12.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -56.35 -54.9 40.07 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.249 172.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -78.23 -20.5 51.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.838 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.73 28.37 70.94 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.285 174.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.549 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.0 OUTLIER -100.1 9.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 122.402 1.096 . . . . 0.0 110.073 -176.332 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.49 ' ND2' HD23 ' A' ' 25' ' ' LEU . 2.4 t-20 -88.45 8.33 28.44 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.991 -1.459 . . . . 0.0 112.388 -164.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -108.14 8.4 28.03 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.48 -177.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.476 ' O ' HG13 ' A' ' 37' ' ' ILE . 14.8 m -124.94 118.72 26.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.002 175.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -62.03 -41.17 97.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.268 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -66.1 -29.29 69.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.583 0.706 . . . . 0.0 109.767 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.9 m -76.59 -42.75 41.43 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.522 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 33' ' ' SER . 73.0 mt -58.12 -34.96 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.448 ' O ' HG13 ' A' ' 42' ' ' ILE . 35.7 tt0 -63.86 -52.32 60.58 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.834 178.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -67.5 -36.22 80.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.071 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.549 ' HG3' HG21 ' A' ' 30' ' ' VAL . 8.5 mm-40 -67.36 -38.16 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.382 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 20.1 tp -60.28 -36.39 77.72 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 38' ' ' GLU . 85.9 mt -67.79 -50.54 59.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.714 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -59.39 -42.77 92.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.408 -179.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.35 -32.79 72.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.153 0.501 . . . . 0.0 109.837 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 2.2 t -68.29 -31.87 71.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.327 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.5 tp -85.27 -30.97 23.36 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.266 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -97.1 51.99 1.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.823 0.82 . . . . 0.0 110.551 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.7 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -141.93 -170.13 3.07 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.23 178.073 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.492 ' HD2' ' N ' ' A' ' 49' ' ' LYS . 10.8 mptt -97.16 166.12 11.73 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.536 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.32 -43.29 19.36 Favored Glycine 0 C--N 1.329 0.187 0 O-C-N 123.876 0.735 . . . . 0.0 114.471 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.427 ' HD3' ' HA ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -61.55 -36.33 80.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.103 0.477 . . . . 0.0 110.716 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.3 mt-10 -85.09 -34.76 22.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.158 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.27 -43.31 96.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 23.2 tpt180 -72.25 -35.2 68.74 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.488 177.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.873 HD22 HG12 ' A' ' 13' ' ' VAL . 57.8 tp -56.35 -39.05 72.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.384 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.697 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -71.28 -15.07 62.41 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.139 -176.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.1 m-85 -66.32 -34.23 77.51 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.163 0.506 . . . . 0.0 109.665 174.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 97' ' ' ILE . 24.1 m-85 -83.3 -23.77 32.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.712 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.507 ' CD2' HD11 ' A' ' 97' ' ' ILE . 22.5 mt -79.38 -19.33 50.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.15 173.095 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 65' ' ' ALA . . . 92.78 0.32 69.16 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 113.475 175.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.574 ' HB2' ' HG ' ' A' ' 41' ' ' LEU . . . -60.95 -33.73 73.64 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -172.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.697 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -74.26 -8.37 56.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.403 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm 68.69 -7.16 0.75 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.145 0.578 . . . . 0.0 111.403 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 62' ' ' THR . 19.6 t70 -72.03 -23.96 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.863 0.84 . . . . 0.0 109.245 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.608 ' HB3' ' HA2' ' A' ' 60' ' ' GLY . . . -90.94 -167.52 1.84 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.69 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.652 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -62.84 133.29 54.49 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.091 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.56 -21.3 52.72 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -77.85 -26.26 49.26 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.949 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 66' ' ' ALA . 15.0 pt -76.35 -22.87 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 120.964 0.411 . . . . 0.0 110.203 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.34 -48.68 72.16 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.71 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 18.9 m -63.16 -34.17 77.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.218 174.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HB3' ' O ' ' A' ' 69' ' ' ILE . 12.4 tp10 -53.74 -33.52 55.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.236 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.69 -53.57 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.324 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.62 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 41.8 p -58.92 -33.56 70.71 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.71 ' HG2' ' O ' ' A' ' 71' ' ' SER . 21.6 mmt180 -64.43 -57.45 17.29 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.214 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 49.3 Cg_endo -71.11 -15.62 32.07 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.857 1.704 . . . . 0.0 112.74 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.8 mmt -73.05 -19.98 61.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.419 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.43 ' HA ' HD11 ' A' ' 37' ' ' ILE . 23.5 t -61.78 -13.61 25.27 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.789 HG13 ' HG3' ' A' ' 81' ' ' MET . 13.3 p -153.48 148.26 13.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -48.07 111.83 0.49 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.041 0.448 . . . . 0.0 110.424 176.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.789 ' HG3' HG13 ' A' ' 79' ' ' VAL . 21.6 mtp -144.7 178.98 1.26 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -166.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.591 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 33.8 Cg_exo -37.43 1.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.189 1 C-N-CA 127.92 5.747 . . . . 0.0 118.535 170.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.623 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.28 -38.35 0.22 Allowed 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.838 1.199 . . . . 0.0 113.892 -170.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.809 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -51.76 -50.33 60.85 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.4 . . . . 0.0 111.128 176.313 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.67 ' H ' ' HG2' ' A' ' 84' ' ' MET . 6.3 ptmt -88.2 -14.63 38.08 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.237 -0.29 . . . . 0.0 111.377 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.623 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 31.2 mt -59.71 -44.1 92.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.614 0.245 . . . . 0.0 110.846 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.862 ' HB2' HD11 ' A' ' 18' ' ' LEU . 42.6 t -65.89 -21.13 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.276 0.56 . . . . 0.0 111.211 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -82.88 -34.71 26.64 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.0 mttt -62.67 -31.42 72.3 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.478 0.656 . . . . 0.0 109.812 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 87' ' ' CYS . 74.1 mt -66.74 -14.8 63.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.951 -177.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 41.7 mtpt -67.2 -17.49 64.84 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.698 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -66.15 -29.77 70.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.563 . . . . 0.0 109.689 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 60.1 mt -90.42 -50.22 6.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.101 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 16.6 t70 -147.71 132.42 17.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.067 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.3 m -87.44 -20.79 26.12 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.424 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.1 tp60 -78.89 -30.12 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.739 -174.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.531 ' HB ' ' HB3' ' A' ' 58' ' ' TYR . 10.3 tt -54.25 -29.18 19.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.854 0.835 . . . . 0.0 110.109 173.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.633 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 45.1 t -86.3 -58.71 2.52 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.624 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -96.17 42.89 1.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.798 -173.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.2 tp -70.57 -56.63 6.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.956 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 69.38 135.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 O-C-N 124.122 0.889 . . . . 0.0 112.016 177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.683 174.903 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.449 -1.117 0 N-CA-C 109.999 -0.808 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.952 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -78.65 -39.87 20.03 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.4 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HB1' ' CB ' ' A' ' 87' ' ' CYS . . . -173.67 -90.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.834 0.35 . . . . 0.0 110.347 -176.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -152.58 -71.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.584 ' HB2' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -81.18 146.52 30.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -46.78 -56.79 5.65 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -171.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.836 HG12 HD22 ' A' ' 55' ' ' LEU . 58.7 t -61.13 -50.98 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 117.958 0.345 . . . . 0.0 111.742 -173.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HA ' HD21 ' A' ' 55' ' ' LEU . 49.9 t -60.62 -33.87 73.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.525 0.678 . . . . 0.0 109.913 176.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.81 ' HG3' ' HA3' ' A' ' 8' ' ' GLY . 24.0 ttmt -67.17 -48.8 66.88 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.282 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.67 -42.93 84.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.843 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -66.35 -57.01 8.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 80.0 mt -67.18 -39.05 86.35 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.157 -173.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.952 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 27.3 t-20 -68.7 -55.9 9.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -176.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 -64.28 -32.95 74.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.433 0.161 . . . . 0.0 111.433 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -64.12 -47.28 80.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.982 0.896 . . . . 0.0 109.622 174.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 49.8 t80 -57.96 -55.94 28.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.868 -177.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -71.46 -26.84 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.259 -176.493 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.41 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 46.1 t -65.91 -47.56 74.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.923 0.392 . . . . 0.0 110.2 176.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -60.07 -48.37 82.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.605 -179.314 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 22' ' ' TYR . 43.3 mm -62.2 -45.51 98.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.702 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -70.75 -38.13 73.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.374 -177.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.479 ' HB2' HG12 ' A' ' 30' ' ' VAL . 60.0 mtm180 -76.32 -13.64 60.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 111.726 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.51 38.31 57.85 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.7 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 1.9 p -125.07 91.31 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.295 -0.452 . . . . 0.0 110.042 -176.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -168.88 -170.29 1.14 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.026 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 62.38 35.11 15.17 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.605 ' O ' HG12 ' A' ' 37' ' ' ILE . 47.2 m -155.28 101.15 2.2 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.483 HD11 ' HD2' ' A' ' 75' ' ' ARG . 3.2 mm? -47.16 -43.94 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.16 -46.63 85.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.642 . . . . 0.0 110.458 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.6 m -71.14 -35.48 71.71 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.673 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 33' ' ' SER . 14.9 mm -55.4 -34.27 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.089 0.471 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -61.36 -47.79 84.26 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.914 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -66.63 -36.78 83.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.097 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -60.94 -53.28 59.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -57.42 -41.26 80.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.67 0.271 . . . . 0.0 110.692 177.611 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.01 -44.89 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.592 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.2 m -58.74 -46.32 87.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.024 0.44 . . . . 0.0 110.34 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -76.12 -17.45 59.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.6 t -69.01 -47.83 64.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.835 177.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.8 mm? -86.47 -31.22 21.47 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -72.09 -22.88 61.28 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.04 -164.29 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -98.62 173.11 7.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.305 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.89 -47.23 39.89 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 114.659 0.623 . . . . 0.0 114.659 -169.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.9 mptt -60.9 -37.06 80.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 117.153 0.476 . . . . 0.0 110.967 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 30.6 mt-10 -81.61 -34.79 30.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.888 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.434 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 33.2 m-20 -65.94 -23.9 66.7 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 9.2 tpp180 -86.92 -35.04 19.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.235 0.54 . . . . 0.0 109.694 172.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.836 HD22 HG12 ' A' ' 13' ' ' VAL . 29.8 tp -60.99 -36.39 79.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.333 -179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.639 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 21.6 p -65.72 -20.29 66.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.332 -178.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 45.7 m-85 -68.64 -30.94 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 97' ' ' ILE . 91.0 m-85 -85.3 -45.24 12.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.53 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.6 HD23 HD11 ' A' ' 97' ' ' ILE . 88.9 mt -68.7 -12.61 61.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.564 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 77.04 40.49 24.87 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.095 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -107.57 25.1 11.9 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.613 0.721 . . . . 0.0 110.281 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.1 t -149.03 141.76 24.54 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.295 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -80.04 -3.22 47.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 -174.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -92.88 7.95 41.73 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.16 -161.65 1.11 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.78 109.97 0.58 Allowed 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.443 0.464 . . . . 0.0 109.964 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -15.27 50.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.343 -173.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -66.5 -44.71 81.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.358 . . . . 0.0 110.568 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.859 HG23 ' HA3' ' A' ' 60' ' ' GLY . 16.7 tt -72.29 -21.52 20.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.756 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.1 tt -61.15 -46.9 88.63 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.485 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 8.6 m -66.36 -28.51 68.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.719 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 8.5 mm-40 -67.65 -58.26 4.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.708 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.587 ' O ' ' HB2' ' A' ' 77' ' ' MET . 60.9 t -62.32 -44.29 99.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.798 0.333 . . . . 0.0 111.6 -173.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.473 ' HA ' HG21 ' A' ' 37' ' ' ILE . 16.4 p -56.59 -32.56 65.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -176.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.485 ' HD3' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -61.32 -56.75 30.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.267 -175.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.942 ' HB2' ' HG2' ' A' ' 81' ' ' MET . 72.6 Cg_endo -78.77 -27.49 4.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 121.706 1.604 . . . . 0.0 113.444 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.587 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 0.3 OUTLIER -67.21 -19.21 65.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.801 0.334 . . . . 0.0 110.795 -178.067 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.8 t -68.34 -13.36 62.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.547 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.699 HG22 ' H ' ' A' ' 80' ' ' HIS . 5.9 p -129.23 179.25 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.699 ' H ' HG22 ' A' ' 79' ' ' VAL . 14.9 t-80 -55.02 -67.86 0.24 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 122.501 0.32 . . . . 0.0 110.226 -178.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.942 ' HG2' ' HB2' ' A' ' 76' ' ' PRO . 15.4 tpt 67.39 145.71 0.1 Allowed Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 164.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.863 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 42.5 Cg_exo -43.74 4.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.949 1 C-N-CA 127.661 5.574 . . . . 0.0 118.251 168.399 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.607 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.21 -31.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -158.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.83 ' SD ' ' HG3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.75 -45.18 83.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 120.028 1.285 . . . . 0.0 109.997 175.239 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.83 ' HG3' ' SD ' ' A' ' 84' ' ' MET . 90.1 mttt -63.82 -24.2 67.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.148 176.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.775 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 32.7 mt -61.76 -27.38 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.896 -174.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.722 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 18.6 t -75.59 -31.56 59.99 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.57 176.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 4.5 mm-40 -63.35 -43.24 98.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.185 173.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.775 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 0.0 OUTLIER -68.57 -33.94 74.95 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.415 176.084 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 15.5 mt -64.3 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.283 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 54.2 mtpt -67.33 -17.13 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.072 0.463 . . . . 0.0 110.854 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.423 ' HB3' ' O ' ' A' ' 89' ' ' LYS . 58.0 tttm -76.69 -25.53 53.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.772 175.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.65 -52.54 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.736 175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.662 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 11.7 t70 -139.49 134.19 31.93 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.051 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 m -85.71 -30.36 23.21 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -86.27 -14.82 42.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.6 HD11 HD23 ' A' ' 59' ' ' LEU . 14.5 tt -59.7 -27.61 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.027 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 45.4 t -83.12 -30.93 27.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.679 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.28 -94.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.398 -171.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.64 -68.28 0.12 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.544 0.528 . . . . 0.0 110.582 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp 64.24 117.32 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.668 0.747 . . . . 0.0 111.81 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.522 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 89.5 m-85 . . . . . 0 CA--C 1.518 -0.283 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.894 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.613 ' O ' ' HB3' ' A' ' 84' ' ' MET . 56.7 Cg_endo . . . . . 0 N--CA 1.443 -1.446 0 N-CA-C 110.184 -0.737 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -73.77 -27.8 66.33 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.119 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . 177.78 -125.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 O-C-N 124.028 0.487 . . . . 0.0 110.624 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -128.41 -63.56 0.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HB3' ' HA ' ' A' ' 99' ' ' GLU . 18.9 m -70.17 124.66 24.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.243 171.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 3.0 mp0 -46.28 -49.16 17.77 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -169.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.912 HG12 HD22 ' A' ' 55' ' ' LEU . 61.5 t -70.11 -46.81 71.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -167.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 12.7 p -66.47 -30.08 70.34 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.644 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 19.6 ttmt -61.27 -54.7 40.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.6 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.631 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 59.9 mm-40 -52.22 -52.29 53.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.081 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -58.8 -55.4 35.56 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.771 -176.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 87' ' ' CYS . 85.6 mt -63.07 -44.15 96.58 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.991 -172.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.544 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 8.4 t30 -65.61 -49.04 70.18 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 123.143 0.277 . . . . 0.0 111.538 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.631 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 10.5 mtm180 -71.33 -35.89 71.37 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.714 -175.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -64.18 -44.09 93.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.487 0.66 . . . . 0.0 109.497 174.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.521 ' O ' HG12 ' A' ' 26' ' ' ILE . 66.7 t80 -54.81 -55.54 29.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.377 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -70.73 -27.63 64.1 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.972 -178.089 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.477 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 51.4 m -63.37 -52.87 59.88 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.744 176.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.75 HD23 HD22 ' A' ' 31' ' ' ASN . 3.1 mp -60.69 -36.59 79.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.484 0.183 . . . . 0.0 111.38 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.4 mm -67.63 -52.53 39.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.72 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -70.83 -35.01 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.664 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.619 ' HB2' HG12 ' A' ' 30' ' ' VAL . 64.2 mtp180 -75.06 -14.49 60.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.021 0.439 . . . . 0.0 111.242 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.66 40.12 85.89 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.526 -0.629 . . . . 0.0 111.526 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.681 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 3.4 p -127.42 56.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-O 122.519 1.152 . . . . 0.0 110.13 -173.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.75 HD22 HD23 ' A' ' 25' ' ' LEU . 12.8 t-20 -143.68 -163.64 1.7 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.583 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.453 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 94.1 m-85 60.73 30.14 19.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.512 0.673 . . . . 0.0 110.879 -176.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.51 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 32.7 m -153.15 112.84 3.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.745 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.2 mm? -61.85 -41.28 97.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.34 -172.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.48 -27.29 64.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.153 0.501 . . . . 0.0 110.389 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.51 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.0 m -73.88 -45.97 47.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.747 178.071 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 33' ' ' SER . 45.0 mt -61.32 -34.3 60.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -73.41 -25.52 60.57 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.375 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -85.6 -44.86 12.26 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.063 0.458 . . . . 0.0 110.263 176.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -65.89 -35.77 81.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.596 -176.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.778 HD13 HD11 ' A' ' 70' ' ' LEU . 16.4 mt -55.96 -40.05 72.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.273 0.559 . . . . 0.0 109.645 172.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 51.4 mt -72.72 -38.39 58.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.397 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 t -75.25 -50.78 15.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.969 0.414 . . . . 0.0 110.73 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -62.83 -30.92 71.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.027 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 15.6 m -68.07 -27.85 66.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -89.18 -15.18 34.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.218 0.532 . . . . 0.0 110.507 173.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.32 -22.2 41.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.534 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.782 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -76.94 -168.18 1.01 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.813 179.231 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -93.84 167.97 11.29 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.32 -46.53 35.53 Favored Glycine 0 CA--C 1.517 0.197 0 O-C-N 123.662 0.601 . . . . 0.0 114.442 -171.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 100' ' ' LEU . 16.7 tppt? -59.35 -38.79 81.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 117.146 0.473 . . . . 0.0 110.33 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.782 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.5 mt-10 -80.37 -36.49 33.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.204 -176.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -59.28 -47.79 84.04 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 174.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -68.13 -37.5 81.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.48 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.912 HD22 HG12 ' A' ' 13' ' ' VAL . 33.8 tp -52.72 -38.6 61.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.088 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 68.5 m -71.87 -15.04 62.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -73.19 -23.11 60.37 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.497 ' HB3' HG13 ' A' ' 97' ' ' ILE . 89.4 m-85 -85.33 -46.7 10.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.55 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.859 ' HA ' HD11 ' A' ' 97' ' ' ILE . 86.9 mt -62.21 -24.66 67.36 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.702 -178.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.76 7.11 61.72 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.626 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.407 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -90.49 59.85 4.43 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.451 0.643 . . . . 0.0 110.822 -178.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.3 t -166.11 146.93 6.57 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.449 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -87.2 24.42 1.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.527 0.68 . . . . 0.0 110.445 -176.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -125.72 13.83 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.205 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -141.46 -176.0 4.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.721 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -73.89 88.78 1.84 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.965 0.412 . . . . 0.0 111.155 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -18.84 65.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.801 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -61.28 -21.72 64.2 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 66' ' ' ALA . 10.9 pt -85.44 -14.48 10.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.089 0.471 . . . . 0.0 110.48 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.778 HD11 HD13 ' A' ' 41' ' ' LEU . 21.8 tp -69.88 -15.42 63.07 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.876 -171.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.416 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 2.8 p -61.12 -29.66 69.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.535 174.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 58.6 mm-40 -63.47 -29.11 70.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.387 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.477 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.2 t -88.41 -56.79 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.192 0.52 . . . . 0.0 111.122 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 6.6 p -53.14 -47.83 68.39 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.283 -172.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.585 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.4 mpt_? -65.09 -51.78 52.91 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.7 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 45.9 Cg_exo -61.76 -34.96 81.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.549 1.499 . . . . 0.0 113.247 175.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 21.0 mmt -68.08 -13.55 62.29 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.2 t -67.7 -13.47 62.12 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -175.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.516 HG13 ' H ' ' A' ' 80' ' ' HIS . 2.8 p -134.77 -62.23 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.516 ' H ' HG13 ' A' ' 79' ' ' VAL . 13.4 t60 -176.33 -89.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -173.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.7 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 49.5 mtp 68.11 167.56 0.12 Allowed Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 163.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 4.9 Cg_endo -44.92 4.02 0.01 OUTLIER 'Trans proline' 0 C--O 1.205 -1.151 1 C-N-CA 127.987 5.791 . . . . 0.0 117.969 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -34.6 -26.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -148.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.624 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -54.21 -42.98 70.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 120.471 1.487 . . . . 0.0 109.744 166.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.761 ' HB3' ' HB2' ' A' ' 82' ' ' PRO . 23.9 ttmm -71.1 -17.71 62.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.966 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 83' ' ' ALA . 66.9 mt -64.84 -25.39 37.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.414 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.6 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 51.0 t -80.32 -30.58 38.15 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.59 173.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.53 -40.65 93.19 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 8.1 tppt? -57.96 -47.51 82.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.74 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 97' ' ' ILE . 16.4 mt -65.67 -24.56 67.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.055 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.6 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 39.8 mtpt -69.99 -14.99 62.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.834 -177.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 34.9 pttt -73.94 -22.75 59.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.189 -0.605 . . . . 0.0 109.405 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -87.92 -45.88 9.87 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.913 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 10.5 t70 -142.46 138.02 30.72 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.689 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.2 m -87.02 -28.04 22.85 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -175.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -85.88 -14.23 45.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.114 0.483 . . . . 0.0 110.911 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.859 HD11 ' HA ' ' A' ' 59' ' ' LEU . 18.8 tt -55.02 -27.21 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.089 -175.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 14' ' ' CYS . 15.8 p -85.39 -38.88 18.21 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -169.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.677 ' HG3' ' H ' ' A' ' 100' ' ' LEU . 6.5 pt-20 -79.58 -98.43 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.121 -170.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.677 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 94.5 mt 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 117.841 0.292 . . . . 0.0 110.326 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -49.64 134.98 19.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.53 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.0 110.556 -177.346 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo . . . . . 0 N--CA 1.444 -1.417 0 N-CA-C 111.317 -0.301 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.518 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -90.32 -32.46 9.56 Favored Glycine 0 N--CA 1.436 -1.301 0 C-N-CA 119.111 -1.519 . . . . 0.0 111.733 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -166.21 -81.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.892 0.377 . . . . 0.0 110.232 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -176.48 -47.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.825 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.7 p -66.21 -90.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.357 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 31.2 tt0 -172.45 -81.68 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.926 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -56.86 -45.08 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 111.488 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.5 t -64.69 -35.42 80.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.852 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 13.3 ptpt -71.82 -37.73 70.28 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.108 0.48 . . . . 0.0 109.717 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.582 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 78.2 mm-40 -58.82 -51.31 70.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.335 178.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.38 -55.63 26.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.572 -176.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 86.5 mt -59.79 -43.19 94.54 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.62 0.248 . . . . 0.0 111.506 -174.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 14.4 t-20 -74.76 -44.01 51.9 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.865 -176.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 7.0 tpp85 -55.2 -51.2 67.32 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.271 0.557 . . . . 0.0 110.158 175.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CD2' ' SD ' ' A' ' 77' ' ' MET . 29.6 t80 -59.57 -42.63 92.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.659 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -52.96 -57.01 11.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.513 178.7 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -76.18 -30.94 58.26 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.755 -173.662 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 4.8 t -68.34 -36.73 79.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.937 0.399 . . . . 0.0 110.288 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -67.21 -42.95 83.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.43 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -63.69 -43.31 98.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.085 175.418 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -55.86 -55.53 31.38 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.085 0.469 . . . . 0.0 110.777 177.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.4 mtm-85 -66.78 -17.35 64.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.163 -177.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.51 31.52 33.32 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.583 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.733 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -131.04 100.69 4.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.074 -175.109 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -168.8 -170.58 1.2 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.9 t80 73.9 -49.57 0.68 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.784 0.834 . . . . 0.0 111.545 176.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 3.9 m -66.95 114.99 6.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.942 0.401 . . . . 0.0 110.317 177.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.693 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -58.39 -45.15 88.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.983 -176.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -28.52 69.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.266 0.555 . . . . 0.0 110.431 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.3 m -79.78 -45.49 18.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.524 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' SER . 37.4 mt -60.11 -27.93 40.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -64.12 -41.53 97.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.773 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 18.8 mmmt -74.22 -45.52 47.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.686 0.755 . . . . 0.0 109.981 -179.197 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.92 -33.45 75.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.743 -1.117 . . . . 0.0 111.769 -174.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 24.2 tp -59.8 -29.24 68.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.551 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 81.4 mt -84.48 -50.5 14.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.297 175.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -55.42 -37.93 68.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.981 -178.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -71.63 -33.81 69.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.721 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.551 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 26.6 p -85.41 -13.46 49.28 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 119.926 -0.709 . . . . 0.0 111.52 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.8 tp -86.58 -22.17 26.43 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 170.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -81.99 -23.22 36.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.041 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -79.89 -172.32 3.32 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.542 -175.062 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -99.23 173.85 6.59 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.853 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.14 -41.38 38.39 Favored Glycine 0 C--N 1.332 0.308 0 N-CA-C 114.993 0.757 . . . . 0.0 114.993 -169.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.9 tppt? -60.81 -43.54 98.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 0.0 109.955 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 19.1 mt-10 -80.45 -32.5 37.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.58 -174.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.63 -52.49 64.15 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -63.28 -35.63 81.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.486 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.926 HD22 HG12 ' A' ' 13' ' ' VAL . 52.1 tp -56.52 -33.57 66.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.029 177.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.793 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 51.3 t -70.67 -25.32 62.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.378 -177.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.531 ' CZ ' HG21 ' A' ' 62' ' ' THR . 64.3 m-85 -69.05 -28.14 66.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.207 0.527 . . . . 0.0 109.708 174.499 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.548 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.1 m-85 -86.83 -34.27 19.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.926 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.3 mt -71.51 -14.87 62.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.826 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.579 ' HA3' HD11 ' A' ' 69' ' ' ILE . . . 91.22 11.85 60.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.899 -0.667 . . . . 0.0 113.744 171.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.793 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -84.02 -43.29 15.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.006 0.403 . . . . 0.0 111.107 -178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.531 HG21 ' CZ ' ' A' ' 57' ' ' TYR . 1.2 m -64.65 154.41 36.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -178.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -80.3 49.18 1.09 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.901 0.381 . . . . 0.0 111.659 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.86 46.01 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.414 ' CB ' ' HA2' ' A' ' 60' ' ' GLY . . . -148.79 -167.77 2.92 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.169 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.9 123.17 21.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -76.34 -29.82 57.39 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -84.85 -29.75 25.05 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.579 HD11 ' HA3' ' A' ' 60' ' ' GLY . 24.2 pt -68.17 -16.89 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 120.758 0.313 . . . . 0.0 111.287 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 70' ' ' LEU . 3.0 tt -63.23 -37.98 89.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.9 m -68.39 -24.59 64.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.667 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.07 -24.93 65.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.009 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.499 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 59.0 t -87.57 -57.71 4.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 0.0 110.937 175.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.416 HG22 ' CG2' ' A' ' 37' ' ' ILE . 12.4 p -54.61 -54.97 34.48 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -173.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.693 ' HA ' HD11 ' A' ' 34' ' ' LEU . 9.3 mpt_? -54.4 -50.9 82.45 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 123.234 0.334 . . . . 0.0 111.867 -174.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.499 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 32.3 Cg_exo -64.96 -45.39 8.11 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 121.33 1.353 . . . . 0.0 112.707 173.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.429 ' SD ' ' CD2' ' A' ' 21' ' ' PHE . 53.5 ttm -65.25 -13.19 57.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.79 0.329 . . . . 0.0 111.812 -175.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.1 m -58.66 -19.25 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.726 175.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.465 HG13 ' HG2' ' A' ' 81' ' ' MET . 10.7 p -141.53 167.65 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 174.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -70.05 110.02 4.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.883 -0.51 . . . . 0.0 110.15 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.753 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 21.9 mmm -130.31 172.94 6.42 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -167.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.753 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.7 Cg_exo -39.19 1.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.824 1 C-N-CA 127.89 5.727 . . . . 0.0 118.68 171.032 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -39.83 -26.09 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -168.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.72 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.17 -41.3 79.0 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 122.129 0.966 . . . . 0.0 109.269 172.045 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 29.5 mtpt -85.26 -22.55 28.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.078 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.578 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 58.8 mt -66.93 -33.26 62.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 C-N-CA 120.399 -0.521 . . . . 0.0 109.878 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.497 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 34.6 t -62.63 -31.97 72.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.187 0.518 . . . . 0.0 110.299 173.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.661 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 33.8 tt0 -68.5 -34.82 76.56 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.684 177.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.213 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.28 -42.53 30.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.416 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.661 ' HG3' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -69.75 -13.77 62.45 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.819 0.342 . . . . 0.0 110.642 179.822 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -59.72 -37.75 79.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.157 0.503 . . . . 0.0 109.744 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.0 -46.52 18.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.815 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.592 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 15.2 t70 -142.34 108.16 5.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.939 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' SER . . . . . 0.615 ' HA ' ' HB2' ' A' ' 91' ' ' LYS . 13.0 t -73.48 -17.0 61.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.209 -175.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 92.5 mt-30 -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.64 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.548 HG12 ' HB3' ' A' ' 58' ' ' TYR . 84.0 mt -56.79 -48.84 80.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.575 0.702 . . . . 0.0 110.26 173.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.49 -48.87 13.15 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.814 -177.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -87.58 37.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.039 -176.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.656 HD23 HG11 ' A' ' 13' ' ' VAL . 21.3 tp -74.05 -57.18 4.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 65.13 122.45 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.207 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.47 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 96.6 m-85 . . . . . 0 CA--C 1.518 -0.287 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.269 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.452 -0.943 0 N-CA-C 110.621 -0.569 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.893 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -77.82 -34.72 37.76 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.283 -175.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -169.12 -92.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.931 0.396 . . . . 0.0 111.165 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -155.19 -47.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.259 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -76.12 -107.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 5.1 tp10 -153.84 -72.97 0.13 Allowed 'General case' 0 C--O 1.219 -0.5 0 O-C-N 122.105 -0.372 . . . . 0.0 111.457 -175.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 55' ' ' LEU . 77.7 t -57.75 -55.27 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.559 ' HA ' ' CD1' ' A' ' 55' ' ' LEU . 35.4 t -59.53 -35.44 74.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.479 0.657 . . . . 0.0 110.441 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.57 ' HG3' ' H ' ' A' ' 8' ' ' GLY . 6.3 ttmt -67.7 -46.52 72.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.755 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.593 ' HB3' HH21 ' A' ' 20' ' ' ARG . 26.0 mm-40 -57.41 -53.79 54.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.961 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -56.98 -55.37 35.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.246 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 69.8 mt -61.44 -55.35 32.29 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 120.533 0.206 . . . . 0.0 111.46 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.893 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 26.3 t-20 -66.47 -45.53 79.41 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 16' ' ' GLU . 18.6 ttp85 -67.3 -39.04 85.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.438 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -61.33 -46.15 91.47 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 122.308 1.052 . . . . 0.0 109.192 174.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.746 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.2 t80 -55.76 -38.08 69.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 112.864 -1.971 . . . . 0.0 111.974 -175.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -85.46 -28.98 24.67 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.476 178.023 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.591 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 69.0 m -59.9 -40.26 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.886 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.7 mp -69.66 -25.02 63.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.375 179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.0 mm -78.76 -51.61 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.97 -46.4 89.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.177 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.484 ' HB2' HG12 ' A' ' 30' ' ' VAL . 53.2 mtp85 -72.92 -13.64 61.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.009 -177.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.75 45.08 54.65 Favored Glycine 0 C--N 1.332 0.344 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.713 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 6.0 p -138.26 51.21 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 0 CA-C-O 122.378 1.085 . . . . 0.0 109.883 -170.03 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -130.82 179.96 5.66 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.593 -0.692 . . . . 0.0 111.345 -172.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.586 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 71.0 m-85 72.28 -48.14 0.68 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.978 0.911 . . . . 0.0 112.131 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 15.0 m -64.43 104.85 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.44 -41.34 72.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.854 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -63.32 -34.15 77.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.597 0.713 . . . . 0.0 110.197 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 85.9 m -79.71 -43.94 21.73 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.259 -178.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 33' ' ' SER . 67.5 mt -59.34 -31.74 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG3' HD21 ' A' ' 70' ' ' LEU . 35.2 tt0 -61.37 -55.13 34.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.812 175.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' HD12 ' A' ' 42' ' ' ILE . 21.9 tptm -67.13 -35.28 79.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.212 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.06 -34.59 73.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.196 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 41' ' ' LEU . 11.5 mt -61.01 -41.65 96.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 172.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 39' ' ' LYS . 99.0 mt -59.57 -48.67 86.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.735 175.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 t -63.76 -48.71 75.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.891 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.547 ' HZ ' ' HG2' ' A' ' 20' ' ' ARG . 11.3 t80 -63.95 -34.57 78.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.28 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -60.44 -33.25 72.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.632 176.868 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -86.87 -39.39 15.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.44 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.18 -15.66 60.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.931 -173.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.766 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.97 -171.17 0.83 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.865 0.364 . . . . 0.0 111.466 178.849 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.24 164.34 13.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.424 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -47.61 -41.47 18.73 Favored Glycine 0 C--N 1.331 0.253 0 O-C-N 123.661 0.601 . . . . 0.0 114.1 -171.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -61.05 -43.22 99.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.222 0.534 . . . . 0.0 110.569 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 21.0 mt-10 -79.04 -30.42 44.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.171 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -63.57 -18.89 64.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 40.6 mmt180 -86.61 -46.27 10.25 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.858 172.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.64 HD13 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -62.46 -25.13 67.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.775 -174.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.632 ' N ' HD23 ' A' ' 55' ' ' LEU . 25.7 p -72.66 -14.75 61.65 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.255 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.501 ' HA ' ' OG1' ' A' ' 62' ' ' THR . 66.9 m-85 -72.72 -33.72 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.173 0.511 . . . . 0.0 109.626 171.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.417 ' HD2' ' HA ' ' A' ' 55' ' ' LEU . 60.0 m-85 -85.58 -29.24 24.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.569 HD13 ' HG ' ' A' ' 55' ' ' LEU . 8.1 mp -80.23 -6.04 57.18 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.852 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.55 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 84.43 -0.8 89.24 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.233 176.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -80.07 42.54 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.148 0.499 . . . . 0.0 111.465 -177.189 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.501 ' OG1' ' HA ' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -145.17 133.3 21.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.899 -179.232 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.25 -7.7 52.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.74 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -90.5 -18.51 25.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.262 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.71 -160.75 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.377 -175.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.67 132.56 35.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.105 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 p -85.32 -18.09 34.88 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -77.96 -24.07 48.28 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.439 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' HA3' ' A' ' 60' ' ' GLY . 17.3 tt -85.09 -23.84 7.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.309 0.576 . . . . 0.0 109.653 173.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.494 HD21 ' HG3' ' A' ' 38' ' ' GLU . 41.1 tp -63.06 -42.7 99.75 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.094 175.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 p -69.17 -15.42 63.4 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.877 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.547 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 53.8 mm-40 -77.82 -56.67 4.31 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.672 177.365 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.45 -34.02 67.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-O 120.973 0.416 . . . . 0.0 111.748 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.417 HG22 HG22 ' A' ' 37' ' ' ILE . 7.6 p -57.33 -27.52 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -74.17 -54.49 3.36 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.861 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.547 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 23.9 Cg_endo -64.74 -17.73 60.4 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.653 1.569 . . . . 0.0 113.195 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.5 mmt -75.69 -16.53 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.473 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.586 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 34.1 t -86.19 -52.77 5.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.861 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.562 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.3 p -109.06 142.34 21.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.011 -176.416 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.746 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 72.5 m80 -57.15 111.37 1.04 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.844 0.354 . . . . 0.0 110.593 -177.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.562 ' HG3' HG13 ' A' ' 79' ' ' VAL . 32.1 mtp -140.8 170.08 10.24 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -168.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.437 ' C ' HG13 ' A' ' 86' ' ' ILE . 30.1 Cg_exo -41.0 0.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.828 1 C-N-CA 127.623 5.549 . . . . 0.0 118.093 171.966 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.469 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -38.17 -38.61 0.35 Allowed 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 120.195 1.361 . . . . 0.0 114.522 -169.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.4 OUTLIER -60.64 -38.17 83.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.891 -0.506 . . . . 0.0 110.766 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.499 ' N ' ' HG2' ' A' ' 84' ' ' MET . 51.6 mttm -86.25 -22.97 26.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.221 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.469 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 25.8 mt -62.17 -33.1 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.161 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.567 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 41.8 t -63.86 -36.1 82.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.167 0.508 . . . . 0.0 110.604 174.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.7 mt-10 -66.81 -39.14 87.6 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.703 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -62.38 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.678 175.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 93' ' ' LEU . 14.6 mt -60.28 -31.59 70.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.595 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 9.5 mtpm? -65.2 -19.31 65.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.25 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -23.93 50.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 109.789 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.7 mp -84.39 -52.84 5.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.745 175.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -144.16 132.48 21.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.982 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -85.1 -18.45 34.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -174.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.704 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 78.7 mt-30 -67.61 -33.18 74.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.569 0.223 . . . . 0.0 110.644 -178.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 63.5 mt -46.31 -48.96 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.14 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -34.93 15.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.685 -177.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.671 ' HA ' ' HE3' ' A' ' 101' ' ' LYS . 16.3 mm-40 -89.55 21.15 3.55 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -171.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.752 ' HB3' ' HG3' ' A' ' 51' ' ' LYS . 34.0 mt -67.72 -54.22 21.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.443 173.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.671 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 30.0 mmtp 70.18 139.71 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.753 0.787 . . . . 0.0 112.47 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.448 -1.189 0 N-CA-C 111.654 -0.171 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.646 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -77.46 -27.43 59.4 Favored Glycine 0 CA--C 1.507 -0.433 0 C-N-CA 119.316 -1.421 . . . . 0.0 112.088 -171.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 1.017 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -171.29 -97.77 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.756 0.312 . . . . 0.0 110.881 177.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -161.75 176.91 10.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 82.9 m 60.62 -85.57 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 123.213 0.605 . . . . 0.0 111.129 -175.772 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.796 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 37.0 tt0 -179.61 -76.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.925 HG12 HD22 ' A' ' 55' ' ' LEU . 90.6 t -60.4 -39.58 81.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -167.177 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 98' ' ' CYS . 5.7 p -70.98 -32.21 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.049 178.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.796 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.8 ptmt -73.81 -31.14 63.11 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -177.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.33 -51.81 64.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.147 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 44' ' ' PHE . 44.0 t80 -60.53 -53.19 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.041 -179.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.607 HD12 ' HB2' ' A' ' 9' ' ' ALA . 84.7 mt -58.82 -47.61 84.21 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.126 0.266 . . . . 0.0 111.549 -174.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.514 ' HB2' ' CA ' ' A' ' 8' ' ' GLY . 29.0 t-20 -60.2 -49.46 77.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.716 0.293 . . . . 0.0 111.181 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -61.12 -46.06 92.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.275 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -65.83 -47.65 74.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.172 0.511 . . . . 0.0 110.601 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.479 ' O ' HG12 ' A' ' 26' ' ' ILE . 64.1 t80 -51.33 -50.27 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.713 -178.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.531 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -78.52 -33.11 48.2 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.543 -176.583 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 8.4 t -62.68 -36.02 81.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 0.0 110.786 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.824 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.8 mp -72.91 -27.53 61.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.929 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -76.2 -32.97 23.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.51 -57.13 10.06 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.529 0.68 . . . . 0.0 110.502 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -75.23 -21.43 58.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.486 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.97 45.91 90.9 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.422 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 ' HG ' ' A' ' 25' ' ' LEU . 2.8 m -96.93 4.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.541 0.686 . . . . 0.0 111.461 -173.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.465 HD21 HD23 ' A' ' 25' ' ' LEU . 20.9 m120 -82.56 -171.32 3.42 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.972 -170.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 92.7 m-85 71.76 -34.9 0.31 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.502 0.721 . . . . 0.0 111.252 -176.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 16.6 m -88.09 103.02 15.35 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.6 mm? -59.09 -38.99 80.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.243 -176.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.4 -38.07 85.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.067 0.461 . . . . 0.0 110.674 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.506 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 23.0 m -73.7 -46.14 47.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.757 -178.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.436 HG22 HG22 ' A' ' 74' ' ' THR . 48.1 mt -59.97 -31.63 48.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.476 0.655 . . . . 0.0 109.281 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -70.09 -43.67 70.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.652 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HD3' ' C ' ' A' ' 39' ' ' LYS . 12.7 tmtt? -66.92 -42.06 86.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.076 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HG3' HG21 ' A' ' 30' ' ' VAL . 55.3 mm-40 -67.72 -33.51 75.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.486 -179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.611 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 13.1 mt -54.0 -51.75 62.95 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 170.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.69 -49.78 81.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -58.83 -48.76 80.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.504 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.403 ' HD2' ' CE2' ' A' ' 17' ' ' PHE . 14.7 t80 -67.33 -31.37 71.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.881 0.372 . . . . 0.0 110.187 -175.209 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 62.8 m -64.68 -37.91 89.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.64 177.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 46' ' ' LEU . 2.0 tm? -86.06 -36.46 19.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.131 0.491 . . . . 0.0 110.512 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.33 -22.16 66.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.0 -175.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.764 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -76.76 -169.44 1.27 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.635 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -97.82 175.74 6.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.645 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.91 -40.94 35.74 Favored Glycine 0 CA--C 1.518 0.276 0 O-C-N 123.621 0.576 . . . . 0.0 114.463 -170.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 102' ' ' TYR . 0.2 OUTLIER -62.2 -50.85 70.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.07 0.435 . . . . 0.0 110.484 -179.648 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.764 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 1.6 mp0 -71.75 -34.23 69.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.621 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -57.44 -45.6 84.5 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -71.61 -37.61 70.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.39 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.925 HD22 HG12 ' A' ' 13' ' ' VAL . 22.9 tp -53.75 -32.59 52.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.555 178.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 32.6 t -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -176.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.49 -29.76 62.7 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.572 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.458 ' HB3' HG13 ' A' ' 97' ' ' ILE . 87.7 m-85 -74.68 -44.59 49.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.406 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.697 HD23 HD11 ' A' ' 97' ' ' ILE . 77.6 mt -67.28 -27.77 67.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.012 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' HA3' HG21 ' A' ' 69' ' ' ILE . . . 91.56 -9.65 76.61 Favored Glycine 0 C--O 1.225 -0.462 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.756 172.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.648 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -67.14 -16.16 64.15 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.159 0.48 . . . . 0.0 112.264 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -72.04 138.72 48.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -74.52 47.34 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.24 0.543 . . . . 0.0 111.552 -176.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -132.4 -32.3 1.35 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.516 178.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.12 -161.23 0.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.622 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 69' ' ' ILE . . . -63.32 140.17 58.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 174.275 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' HD13 ' A' ' 70' ' ' LEU . 33.3 p -85.74 -24.49 26.88 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -69.13 -30.05 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.39 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 66' ' ' ALA . 19.5 tt -66.71 -22.6 29.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.779 0.323 . . . . 0.0 110.654 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' A' ' 67' ' ' THR . 10.3 mp -61.02 -53.26 59.45 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.64 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 4.4 p -65.92 -34.02 77.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.544 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -58.65 -31.15 67.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.646 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.28 -46.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.991 0.424 . . . . 0.0 110.649 175.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.64 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 46.5 p -59.47 -36.04 75.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 71' ' ' SER . 1.5 mpp_? -58.93 -55.81 42.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.214 -178.064 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.61 -39.75 20.11 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.266 1.311 . . . . 0.0 112.421 175.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.1 mmt -60.27 -19.5 55.08 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.3 t -62.3 -14.97 44.74 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.553 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -151.47 175.75 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -176.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.553 ' H ' HG22 ' A' ' 79' ' ' VAL . 12.8 m-70 -64.43 122.44 16.75 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.47 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 43.0 mmm -140.71 167.9 16.18 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -170.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 76.3 Cg_exo -46.46 0.4 0.02 OUTLIER 'Trans proline' 0 C--O 1.208 -1.016 1 C-N-CA 126.966 5.11 . . . . 0.0 117.3 176.09 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.574 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -35.9 -40.18 0.18 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 -156.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' MET . . . . . 1.017 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.21 -36.17 68.13 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.672 0.669 . . . . 0.0 110.826 174.624 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 19.1 mtpp -85.12 -20.43 30.33 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.369 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 32.7 mt -64.42 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.516 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.695 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 51.6 t -66.42 -22.2 66.22 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.743 177.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.2 mt-10 -75.74 -37.98 58.88 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.592 175.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.59 -30.82 71.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.031 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' CYS . 93.4 mt -70.09 -14.97 62.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.247 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 30.7 mtpp -67.81 -17.55 64.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.701 0.286 . . . . 0.0 110.645 178.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -69.51 -28.14 65.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 0.0 109.896 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.0 mp -88.58 -48.7 7.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.581 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 8.8 t70 -146.44 126.23 13.5 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.9 m -78.21 -26.21 47.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.68 0.276 . . . . 0.0 111.517 -174.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.4 -12.57 51.75 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.598 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.697 HD11 HD23 ' A' ' 59' ' ' LEU . 17.7 tt -48.35 -34.05 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.595 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 30.5 p -82.36 -28.45 31.54 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.102 -176.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -79.18 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.422 -171.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 8.5 mp 64.48 -62.07 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.365 0.666 . . . . 0.0 111.475 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 69.8 mmtt 69.47 129.0 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.39 0.676 . . . . 0.0 111.141 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.462 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 80.4 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.049 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.45 -1.051 0 CA-C-O 121.157 0.399 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.632 ' HA3' ' HA ' ' A' ' 15' ' ' LYS . . . -71.92 -23.96 77.26 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.587 -0.816 . . . . 0.0 111.801 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -167.34 -93.95 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 120.714 0.292 . . . . 0.0 111.565 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -164.16 -32.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.793 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.84 -90.09 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.232 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 43.3 tt0 -170.81 -76.73 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.767 HG12 HD22 ' A' ' 55' ' ' LEU . 26.4 t -60.32 -46.13 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 111.11 -173.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.62 ' HA ' HD21 ' A' ' 55' ' ' LEU . 45.6 t -63.98 -28.89 70.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.374 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.632 ' HA ' ' HA3' ' A' ' 8' ' ' GLY . 55.1 mtpt -65.1 -50.46 66.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.596 0.712 . . . . 0.0 109.608 174.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.5 mm-40 -54.51 -55.15 32.08 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.371 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.452 ' HB2' HD23 ' A' ' 55' ' ' LEU . 24.4 t80 -58.28 -55.67 31.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.637 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.489 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 92.4 mt -61.98 -48.05 82.1 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -173.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.6 -42.85 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.258 0.551 . . . . 0.0 110.686 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -70.74 -36.84 73.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.203 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -59.36 -45.86 90.25 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.544 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -52.68 -56.79 12.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.451 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -25.12 63.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.791 -175.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.574 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 74.4 m -67.76 -56.02 10.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.864 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.646 HD12 HG22 ' A' ' 30' ' ' VAL . 3.9 mm? -61.01 -39.02 88.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.275 -177.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' TYR . 47.4 mm -65.83 -37.29 79.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.867 0.365 . . . . 0.0 110.81 177.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.84 -45.0 65.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.777 ' HG3' HG13 ' A' ' 30' ' ' VAL . 2.8 ptm180 -74.69 -13.6 60.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.905 0.383 . . . . 0.0 111.34 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.52 32.89 14.68 Favored Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.403 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.777 HG13 ' HG3' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -142.37 112.54 2.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -178.895 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.838 ' HA ' HD11 ' A' ' 37' ' ' ILE . 0.2 OUTLIER -169.12 15.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -179.282 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -125.06 13.68 8.41 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 -174.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.633 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 49.4 m -122.32 124.47 43.8 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.6 mm? -68.91 -38.62 79.69 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.45 -15.64 60.41 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.414 0.626 . . . . 0.0 109.79 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.633 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 37.8 m -84.06 -48.2 10.15 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.943 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.838 HD11 ' HA ' ' A' ' 31' ' ' ASN . 33.7 mm -59.44 -29.74 42.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.51 -43.31 93.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.782 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 14.5 mmmm -83.71 -34.62 24.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.121 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' HD11 ' A' ' 25' ' ' LEU . 11.2 mm-40 -66.39 -33.88 76.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.3 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.76 -34.09 72.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.114 0.483 . . . . 0.0 109.845 171.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.643 HG12 ' HA ' ' A' ' 62' ' ' THR . 80.9 mt -73.11 -51.6 25.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.232 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.9 t -58.78 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.755 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -65.57 -35.57 81.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.017 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 25.9 t -65.07 -33.34 75.8 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.87 177.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.6 tp -87.07 -15.93 37.09 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.187 0.518 . . . . 0.0 111.05 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -90.48 -14.96 31.71 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.937 -175.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -92.37 -169.91 2.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.548 -173.582 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -94.82 173.62 7.51 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.875 177.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.44 -49.17 33.13 Favored Glycine 0 C--N 1.33 0.242 0 O-C-N 123.821 0.701 . . . . 0.0 114.651 -168.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.783 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 12.6 mptt -61.98 -41.29 97.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.216 0.508 . . . . 0.0 111.127 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 13.8 mm-40 -68.58 -40.47 80.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.195 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -59.28 -36.52 75.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.48 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -77.62 -37.85 49.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.647 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.767 HD22 HG12 ' A' ' 13' ' ' VAL . 53.3 tp -63.48 -29.5 70.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.154 -174.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 13.4 p -63.59 -27.33 69.17 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.771 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.71 -30.65 71.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 0.0 110.186 175.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 97' ' ' ILE . 85.1 m-85 -86.48 -22.59 26.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.683 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' HG21 ' A' ' 73' ' ' VAL . 87.3 mt -106.19 29.63 6.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.861 0.362 . . . . 0.0 111.772 -175.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.582 ' O ' ' HG ' ' A' ' 70' ' ' LEU . . . 63.15 62.97 4.92 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 113.504 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.6 177.62 7.68 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.643 ' HA ' HG12 ' A' ' 42' ' ' ILE . 42.9 p 62.9 148.12 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.492 1.117 . . . . 0.0 112.31 -179.52 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -84.68 56.43 3.86 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.624 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -163.19 -35.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.165 -175.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.78 -170.42 2.98 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.29 101.85 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.882 0.739 . . . . 0.0 111.056 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -15.42 41.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.262 -169.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -79.35 -46.38 17.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.8 pt -69.8 -14.27 18.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.613 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.2 tt -55.64 -42.8 75.51 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.766 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.608 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 10.8 p -74.23 -28.16 61.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.92 -22.75 62.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.443 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 59' ' ' LEU . 61.7 t -88.07 -55.31 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.044 172.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.479 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 10.6 p -56.06 -43.45 77.92 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 34' ' ' LEU . 11.5 mpt_? -62.36 -53.02 61.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.35 -177.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 53.2 Cg_exo -57.94 -38.81 90.79 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.742 1.628 . . . . 0.0 112.803 172.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.5 mmt -58.75 -25.12 62.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.637 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.2 t -63.12 -14.03 43.63 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.574 HG22 ' H ' ' A' ' 80' ' ' HIS . 9.7 p -149.79 175.01 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.574 ' H ' HG22 ' A' ' 79' ' ' VAL . 28.1 m80 -72.62 109.04 5.98 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.783 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 23.7 mmm -125.56 166.9 18.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 121.936 0.874 . . . . 0.0 113.179 -170.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.783 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.1 Cg_exo -39.89 2.95 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.951 1 C-N-CA 128.211 5.94 . . . . 0.0 118.339 169.525 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.555 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -39.17 -32.78 0.11 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -164.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.601 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.3 OUTLIER -61.87 -35.32 77.95 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.388 0.995 . . . . 0.0 110.397 176.668 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 16.1 ptpt -86.43 -19.59 29.41 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 1.014 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 37.7 mt -61.63 -41.72 91.4 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.327 -179.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.524 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 49.1 t -70.36 -22.32 62.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.322 0.582 . . . . 0.0 110.641 176.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.54 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 17.4 mm-40 -70.13 -26.25 63.86 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 1.014 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 8.5 mtmp? -81.53 -28.99 33.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.494 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.567 ' HA ' HD13 ' A' ' 93' ' ' LEU . 2.8 mm? -63.57 -29.2 70.49 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.474 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 45.2 mttp -55.24 -26.76 41.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.06 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -75.5 -15.55 60.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.567 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.5 mp -91.2 -52.98 4.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.452 176.047 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.563 ' HB3' HG13 ' A' ' 97' ' ' ILE . 25.6 t70 -158.65 138.7 12.19 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.834 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 43.0 m -85.22 -24.63 27.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.191 -176.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.436 ' HB3' ' OD2' ' A' ' 94' ' ' ASP . 59.2 tt0 -70.37 -22.23 62.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.299 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 94' ' ' ASP . 36.3 mt -52.69 -45.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.717 0.77 . . . . 0.0 109.733 172.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 -47.27 9.09 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.972 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.22 42.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.476 HD23 HG11 ' A' ' 13' ' ' VAL . 18.4 tp -70.35 -53.91 14.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.836 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 69.4 121.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.602 0.715 . . . . 0.0 112.003 176.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.783 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.4 m-85 . . . . . 0 CA--C 1.52 -0.209 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.023 178.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo . . . . . 0 CA--C 1.53 0.313 0 CA-C-O 121.162 0.401 . . . . 0.0 111.622 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -98.62 -30.14 7.01 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.577 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . 164.38 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 123.907 0.883 . . . . 0.0 109.855 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -110.86 -19.05 12.95 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.95 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 62.3 m -71.28 -0.99 11.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.902 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.858 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 36.5 tt0 72.85 -65.84 0.34 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 114.892 -1.049 . . . . 0.0 113.626 166.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.905 HG12 HD22 ' A' ' 55' ' ' LEU . 57.6 t -62.61 -42.67 96.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.031 -176.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 29.9 p -74.74 -18.56 60.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.384 175.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 9.6 ptmt -72.1 -38.16 69.4 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -67.74 -51.82 44.79 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.561 175.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -58.09 -54.94 41.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.552 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.9 mt -65.83 -32.75 74.45 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 121.33 -0.148 . . . . 0.0 111.208 -175.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -71.58 -53.95 12.05 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.069 -0.253 . . . . 0.0 110.909 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 68.9 mtp180 -53.16 -51.0 63.42 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.047 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.77 -50.61 72.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.789 -179.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.653 ' O ' HG12 ' A' ' 26' ' ' ILE . 26.3 t80 -54.45 -55.63 26.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.867 -178.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 23' ' ' LYS . 20.2 mmtt -69.9 -38.28 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -175.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.7 t -64.31 -27.87 69.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 0.0 110.46 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.82 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 1.4 tp -82.08 -36.31 27.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.31 -176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 22' ' ' TYR . 44.6 mm -65.41 -49.1 80.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.141 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.0 -42.05 90.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.673 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.539 ' HB2' HG12 ' A' ' 30' ' ' VAL . 81.5 mtm180 -77.34 -12.52 59.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.813 0.34 . . . . 0.0 111.729 -177.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.48 39.61 56.21 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.579 HG13 ' HA ' ' A' ' 25' ' ' LEU . 2.2 p -126.09 27.73 2.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 122.921 1.343 . . . . 0.0 109.444 -170.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.82 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 3.6 t-20 -131.92 99.84 4.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.216 -174.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 3.7 t80 166.13 -28.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.627 1.205 . . . . 0.0 108.507 174.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -82.57 120.85 26.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.219 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -59.29 -38.58 80.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.619 -175.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.52 -25.67 50.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.005 0.431 . . . . 0.0 110.618 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.447 HG21 HG23 ' A' ' 30' ' ' VAL . 29.7 m -77.69 -44.72 27.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.895 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.468 HD11 ' HA ' ' A' ' 78' ' ' SER . 66.0 mt -61.2 -29.78 46.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.228 0.537 . . . . 0.0 109.688 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -63.1 -54.2 41.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.06 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.2 -41.8 99.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.27 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -69.77 -37.56 76.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.816 -176.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.582 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 25.4 mt -57.12 -43.9 82.8 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 172.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.69 -48.48 88.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.453 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.1 m -69.81 -41.67 74.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.772 0.32 . . . . 0.0 111.845 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.509 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 19.2 t80 -67.47 -34.15 76.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.08 0.467 . . . . 0.0 110.349 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 21.2 m -60.97 -29.88 69.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.664 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 tp -88.3 -26.34 22.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.022 0.439 . . . . 0.0 111.273 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -82.22 -19.09 40.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.423 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -74.61 -173.34 1.77 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.871 -178.826 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.8 173.34 7.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.909 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.82 -44.33 55.23 Favored Glycine 0 CA--C 1.518 0.273 0 O-C-N 123.502 0.501 . . . . 0.0 114.24 -170.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -59.78 -38.58 82.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.208 0.504 . . . . 0.0 110.667 178.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.5 mt-10 -83.28 -37.51 23.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.936 -175.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -58.04 -45.86 86.29 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' ' CD2' ' A' ' 57' ' ' TYR . 40.9 tpt85 -76.43 -30.72 57.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.383 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.905 HD22 HG12 ' A' ' 13' ' ' VAL . 14.9 tp -58.5 -31.0 67.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.002 176.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.667 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 33.9 t -57.36 -30.12 64.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.644 -177.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.422 ' CD2' ' HD2' ' A' ' 54' ' ' ARG . 90.3 m-85 -65.73 -16.72 64.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.971 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.422 ' HB3' HG12 ' A' ' 97' ' ' ILE . 87.5 m-85 -86.28 -48.81 8.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.006 0.432 . . . . 0.0 110.583 175.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 78.6 mt -75.26 -17.35 60.33 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.055 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.516 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 98.92 -108.58 3.61 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -176.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.667 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . 50.57 21.82 0.95 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 172.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -140.48 150.99 44.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.139 -178.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -90.54 47.25 1.41 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -151.41 -52.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.921 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.59 104.0 14.85 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.867 -175.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.725 ' O ' HG22 ' A' ' 69' ' ' ILE . . . 49.42 61.19 3.27 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.895 0.747 . . . . 0.0 110.719 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 70' ' ' LEU . 1.0 OUTLIER -61.04 -18.28 56.93 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -167.637 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 23.3 ttpp -66.49 -27.83 68.09 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.052 -0.405 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 66' ' ' ALA . 20.4 tt -68.77 -21.82 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -61.28 -46.12 91.66 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 174.724 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.1 m -69.0 -30.64 69.08 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 65.4 mm-40 -66.62 -58.08 5.9 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.372 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.608 ' O ' ' HB2' ' A' ' 77' ' ' MET . 61.4 t -60.76 -44.77 98.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.401 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.9 p -52.92 -35.33 58.23 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -176.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HD3' ' O ' ' A' ' 71' ' ' SER . 7.1 mpt_? -63.95 -56.08 27.6 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.487 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.531 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 37.8 Cg_endo -70.63 -26.78 23.12 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 121.212 1.275 . . . . 0.0 112.044 173.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 1.6 tpt -67.0 -19.81 65.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 0.0 110.677 -179.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.468 ' HA ' HD11 ' A' ' 37' ' ' ILE . 67.6 m -73.04 -12.85 61.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.704 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.428 HG13 ' HG2' ' A' ' 81' ' ' MET . 2.8 p -130.92 148.87 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.5 m170 -55.42 109.7 0.59 Allowed 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 26.9 mmm -132.6 164.05 46.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -165.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.778 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 32.9 Cg_exo -40.37 3.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.768 1 C-N-CA 128.415 6.076 . . . . 0.0 118.333 169.36 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.541 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.97 -32.83 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.982 2.215 . . . . 0.0 116.982 -159.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.725 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -60.32 -39.49 87.22 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.933 1.242 . . . . 0.0 110.35 173.976 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 38.2 ttpt -80.56 -14.5 58.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.089 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.541 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 47.5 mt -72.02 -42.79 68.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.196 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 46.8 t -69.71 -31.11 68.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.201 0.524 . . . . 0.0 109.607 173.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.441 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 12.0 tp10 -57.42 -48.76 78.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.234 172.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 64.7 mttt -64.9 -29.17 70.1 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 177.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.1 mt -65.56 -14.45 61.12 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.082 -178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.551 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 56.8 mtpt -66.4 -20.33 66.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.58 177.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.426 ' HB3' ' NZ ' ' A' ' 92' ' ' LYS . 3.7 mmmp? -73.16 -21.49 60.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.935 176.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.3 -46.84 5.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.925 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -142.51 119.59 11.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.411 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.4 m -86.74 -13.65 44.68 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.621 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -78.43 -24.77 45.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.708 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.422 HG12 ' HB3' ' A' ' 58' ' ' TYR . 65.4 mt -47.08 -43.26 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.353 179.161 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.95 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 55.7 m -77.1 -15.67 59.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -168.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.84 39.35 3.54 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.658 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.528 ' HB3' HG21 ' A' ' 13' ' ' VAL . 5.6 mp -74.82 -58.61 3.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 168.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt 68.0 132.95 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.834 0.826 . . . . 0.0 112.815 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.625 ' CE2' ' HA ' ' A' ' 13' ' ' VAL . 93.2 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.853 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.448 -1.19 0 N-CA-C 111.413 -0.264 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.607 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -71.26 -34.08 64.36 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.527 -169.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.832 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.52 -90.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.626 0.251 . . . . 0.0 111.16 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -159.32 -73.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.062 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 98' ' ' CYS . 0.6 OUTLIER -84.09 73.28 10.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.657 0.742 . . . . 0.0 112.536 -176.118 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 42.2 mt-10 52.18 -104.17 0.18 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 167.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.523 HG12 HD12 ' A' ' 55' ' ' LEU . 19.0 t -50.17 -51.16 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -161.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.6 t -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.332 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.832 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 7.6 ptpt -72.05 -38.83 69.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 109.913 -178.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.59 -43.51 98.73 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.506 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -62.62 -55.86 23.18 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.366 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.4 mt -62.65 -41.69 99.19 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 121.099 -0.241 . . . . 0.0 111.194 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 58.1 t30 -62.27 -55.75 25.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.508 0.195 . . . . 0.0 111.399 -176.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.19 -39.12 91.64 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE1' ' HA ' ' A' ' 41' ' ' LEU . 81.3 t80 -65.91 -49.73 66.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.242 0.544 . . . . 0.0 110.648 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.696 ' HE2' ' H ' ' A' ' 81' ' ' MET . 67.7 t80 -54.39 -37.18 64.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.629 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.7 mmmt -81.06 -47.05 14.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.326 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -56.11 -33.57 65.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.194 -176.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.766 ' HG ' HG23 ' A' ' 30' ' ' VAL . 2.4 tp -73.65 -33.2 64.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.941 0.4 . . . . 0.0 110.531 -176.113 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 22' ' ' TYR . 25.1 mm -79.99 -34.99 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.5 -43.3 99.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.685 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -71.72 -21.09 61.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.91 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.28 22.72 43.31 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.993 -0.623 . . . . 0.0 111.814 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.766 HG23 ' HG ' ' A' ' 25' ' ' LEU . 32.6 m -105.48 -136.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 CA-C-N 115.095 -0.552 . . . . 0.0 109.802 -177.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.454 ' N ' HG23 ' A' ' 30' ' ' VAL . 66.3 t30 74.1 -177.89 0.17 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.374 0.67 . . . . 0.0 111.444 175.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.408 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 53.1 t80 73.87 -57.12 0.63 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.136 0.974 . . . . 0.0 111.453 -177.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.583 ' O ' HG13 ' A' ' 37' ' ' ILE . 4.1 m -67.39 114.32 5.98 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -55.03 -41.12 70.97 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.801 -177.019 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -39.14 92.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.477 0.656 . . . . 0.0 110.144 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 22.1 m -74.1 -41.67 61.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.5 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.587 HG22 HG22 ' A' ' 74' ' ' THR . 61.5 mt -59.39 -33.96 52.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.83 -54.05 26.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.892 177.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -56.92 -52.88 63.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.152 -177.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.578 ' OE2' HG21 ' A' ' 30' ' ' VAL . 11.3 mt-10 -74.62 -20.76 59.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.805 -175.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.629 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 42.5 tp -63.4 -45.56 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.51 -46.9 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.317 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.483 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 58.4 m -55.34 -52.1 64.6 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.461 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -63.82 -44.92 91.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.373 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 8.1 t -64.42 -43.68 93.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.4 mm? -78.44 -14.31 59.43 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.002 0.429 . . . . 0.0 111.003 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.4 -23.03 40.68 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.572 177.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -74.3 -165.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.797 179.033 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -93.91 170.31 9.65 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.385 -0.197 . . . . 0.0 111.268 -176.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.78 -45.04 61.09 Favored Glycine 0 C--N 1.329 0.188 0 CA-C-N 115.889 -0.596 . . . . 0.0 114.565 -168.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tppt? -59.07 -41.68 88.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.444 0.64 . . . . 0.0 110.328 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.533 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 18.1 mt-10 -77.41 -34.7 54.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.263 -177.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -62.29 -50.41 71.77 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 13.7 tpt180 -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.102 -0.953 . . . . 0.0 111.18 -177.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -52.02 -37.96 55.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.84 -179.592 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.788 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 82.0 m -72.19 -14.48 61.81 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.426 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 63.2 m-85 -68.56 -34.34 75.65 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.581 ' HB3' HG12 ' A' ' 97' ' ' ILE . 28.2 m-85 -87.27 -42.3 13.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.422 176.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' A' ' 55' ' ' LEU . 31.0 mt -60.95 -34.43 74.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.365 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.652 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 103.65 -7.01 49.45 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.956 -178.009 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -76.23 48.2 0.5 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.365 0.602 . . . . 0.0 111.488 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.5 m -155.2 120.67 4.99 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -80.97 41.21 0.57 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.324 0.583 . . . . 0.0 111.091 -175.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -130.43 -6.76 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.268 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.84 -152.43 0.5 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.674 -175.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.41 125.17 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.947 0.403 . . . . 0.0 110.321 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.0 p -80.35 -33.54 37.26 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.066 -172.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.515 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 52.8 tttp -66.9 -42.74 84.97 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.368 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.652 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.0 tt -64.68 -28.39 44.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.814 0.34 . . . . 0.0 110.937 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tt -61.06 -47.8 84.67 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 172.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.525 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.7 m -64.51 -34.67 78.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.463 177.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 51.7 mm-40 -62.77 -23.87 67.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.259 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' MET . 59.8 t -87.66 -56.07 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.205 0.526 . . . . 0.0 110.713 172.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.587 HG22 HG22 ' A' ' 37' ' ' ILE . 20.7 p -59.22 -37.04 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -172.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.525 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.6 mpt_? -64.53 -54.82 34.17 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.581 -176.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -62.09 -35.16 77.45 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.224 1.283 . . . . 0.0 111.462 173.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.521 ' HB3' HG21 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -62.5 -13.31 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.898 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.498 ' HA ' HD11 ' A' ' 37' ' ' ILE . 29.2 t -62.14 -26.33 68.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.212 0.53 . . . . 0.0 110.476 177.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 8.4 p -123.57 152.9 28.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -58.11 120.34 8.43 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 1.4 mmt -125.5 149.85 66.05 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -161.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 66.7 Cg_exo -43.88 2.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.479 0.668 1 C-N-CA 127.27 5.314 . . . . 0.0 116.406 165.04 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.514 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.98 -22.5 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -158.28 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.607 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -48.13 -40.6 24.14 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 118.538 0.608 . . . . 0.0 110.223 164.903 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -87.22 -23.43 24.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 60.3 mt -64.36 -33.9 65.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.96 0.409 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 49.0 t -64.71 -30.16 71.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.4 0.619 . . . . 0.0 110.528 176.415 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -73.26 -32.9 64.96 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.927 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.64 -40.54 92.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.38 0.609 . . . . 0.0 109.7 173.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.581 ' HA ' HD13 ' A' ' 93' ' ' LEU . 94.4 mt -69.14 -17.67 63.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.384 -178.548 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.56 ' HD3' ' SG ' ' A' ' 98' ' ' CYS . 13.9 mmmm -65.26 -21.9 66.79 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.953 0.406 . . . . 0.0 110.664 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -77.45 -27.31 52.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.171 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.581 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.2 mp -83.43 -45.8 13.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.838 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.647 ' HB3' HG13 ' A' ' 97' ' ' ILE . 10.7 t70 -154.09 129.82 10.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.55 177.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.3 t -82.47 -35.61 27.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.019 -176.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.496 ' HA ' ' HB2' ' A' ' 99' ' ' GLU . 27.2 tt0 -69.94 -12.9 61.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.253 -174.551 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.647 HG13 ' HB3' ' A' ' 94' ' ' ASP . 38.2 mt -43.76 -55.17 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.601 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.58 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 26.6 p -91.94 -19.13 22.76 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.669 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 96' ' ' GLN . 42.8 mt-10 -88.71 17.32 5.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.372 -175.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.58 HD12 ' HG ' ' A' ' 55' ' ' LEU . 74.7 mt -62.26 -42.37 99.27 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 99' ' ' GLU . 56.4 mmtt 68.76 141.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.084 0.865 . . . . 0.0 111.605 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.959 176.777 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 84' ' ' MET . 2.0 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 CA-C-O 121.221 0.426 . . . . 0.0 111.351 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.929 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -90.46 -35.5 7.39 Favored Glycine 0 N--CA 1.441 -1.022 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.456 -173.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 173.26 -149.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -123.39 -24.44 4.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.483 0.658 . . . . 0.0 109.81 178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.65 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 21.2 m -76.55 1.02 17.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.832 -175.271 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' CA ' ' HB3' ' A' ' 15' ' ' LYS . 26.4 tp10 69.55 -74.3 0.08 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.942 171.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.684 ' HB ' ' O ' ' A' ' 101' ' ' LYS . 6.6 p -57.83 -46.77 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-O 121.639 0.733 . . . . 0.0 109.727 178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' HD21 ' A' ' 55' ' ' LEU . 8.4 t -68.45 -31.67 71.14 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.302 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.593 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 9.9 ttmt -59.24 -53.25 60.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.332 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.602 ' HG3' ' OH ' ' A' ' 102' ' ' TYR . 22.4 mm-40 -55.21 -49.98 70.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.057 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -62.02 -55.04 33.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.576 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 85.7 mt -56.7 -53.84 53.1 Favored 'General case' 0 C--O 1.223 -0.295 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -173.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.929 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.3 t-20 -67.44 -40.09 85.41 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.397 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.586 HH22 HG22 ' A' ' 48' ' ' THR . 35.6 mtp180 -65.03 -43.34 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.588 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.529 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 55.0 t80 -64.37 -47.27 79.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.3 0.572 . . . . 0.0 109.829 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -51.57 -42.17 61.67 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.648 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.5 mmmt -84.09 -37.76 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.508 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -60.5 -32.27 71.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.156 -178.331 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 22.9 mt -70.56 -27.92 64.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.022 0.439 . . . . 0.0 110.77 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 27.9 mm -80.18 -48.68 19.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.38 -44.91 95.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.452 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.434 ' HB2' HG12 ' A' ' 30' ' ' VAL . 62.8 mtp180 -79.43 -13.79 59.36 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.09 28.76 59.81 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.046 178.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.48 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.4 p -124.23 92.97 2.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.171 0.51 . . . . 0.0 109.858 -175.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -158.87 178.62 9.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.855 -174.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 78' ' ' SER . 25.6 t80 75.91 -55.39 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.462 1.105 . . . . 0.0 112.301 175.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.725 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 8.6 m -60.79 118.39 6.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.083 0.468 . . . . 0.0 110.91 -177.202 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.27 -41.72 89.52 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.578 -174.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.61 -26.14 60.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 18.7 m -74.77 -45.49 43.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.302 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.616 HG21 ' HA ' ' A' ' 74' ' ' THR . 21.9 mm -58.45 -34.29 50.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.41 -52.18 59.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.75 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.746 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -57.42 -37.31 72.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.775 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.48 ' HG3' HG21 ' A' ' 30' ' ' VAL . 59.1 mm-40 -85.13 -28.63 25.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.849 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.44 -42.5 92.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.1 mt -61.48 -52.19 64.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.843 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -65.04 -44.71 88.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.955 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -70.84 -27.02 63.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.47 . . . . 0.0 110.287 -176.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.5 t -62.95 -25.66 68.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.981 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -85.83 -37.5 19.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.47 56.41 3.57 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.563 0.697 . . . . 0.0 110.365 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.788 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -153.99 -173.4 4.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.487 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -97.35 171.89 8.12 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.416 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.21 29.9 Favored Glycine 0 C--N 1.331 0.252 0 O-C-N 123.603 0.565 . . . . 0.0 114.039 -173.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.76 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 0.6 OUTLIER -56.98 -43.87 82.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.951 0.405 . . . . 0.0 110.888 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.788 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 12.5 mt-10 -82.64 -32.84 28.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.97 -176.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -61.04 -37.1 81.4 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 18.7 tpt180 -82.07 -32.61 30.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.071 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.834 ' HA ' ' CZ ' ' A' ' 58' ' ' TYR . 34.9 tp -50.08 -46.94 53.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.236 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.446 ' SG ' HG23 ' A' ' 62' ' ' THR . 1.6 p -63.72 -17.78 63.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.722 -174.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.8 m-85 -62.75 -51.0 68.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.834 ' CZ ' ' HA ' ' A' ' 55' ' ' LEU . 1.8 p90 -87.32 -17.52 32.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.23 -175.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.2 mt -78.08 -31.1 49.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.443 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.27 91.31 2.21 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.872 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -160.06 -53.48 0.05 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.115 0.484 . . . . 0.0 110.044 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.446 HG23 ' SG ' ' A' ' 56' ' ' CYS . 2.9 p -82.3 139.35 34.22 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.58 178.219 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -81.81 6.35 15.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -90.17 5.8 45.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.539 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.54 -152.06 0.4 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.888 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.26 110.88 2.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.153 0.501 . . . . 0.0 110.908 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.9 p -84.99 -19.01 32.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.456 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -71.96 -47.33 53.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.232 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.524 HD11 HD22 ' A' ' 90' ' ' LEU . 14.5 tt -65.83 -16.94 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.11 -176.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.3 tt -54.17 -46.32 72.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.329 0.585 . . . . 0.0 109.624 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.415 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 7.1 m -67.89 -25.13 65.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.791 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -73.51 -18.17 61.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 44.5 t -88.54 -47.67 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.166 0.507 . . . . 0.0 110.848 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.616 ' HA ' HG21 ' A' ' 37' ' ' ILE . 55.9 p -59.06 -39.6 82.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.453 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.3 OUTLIER -61.31 -55.52 42.77 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.827 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.636 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 11.8 Cg_endo -61.05 -42.09 39.05 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 121.223 1.282 . . . . 0.0 112.742 177.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mmt -64.28 -20.69 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.676 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 33.6 t -60.36 -27.26 67.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.485 178.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 80' ' ' HIS . 4.7 p -127.5 -87.32 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.001 178.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.893 ' H ' HG13 ' A' ' 79' ' ' VAL . 91.1 m-70 -150.69 -80.06 0.12 Allowed 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 177.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 35.1 mtp 68.81 167.4 0.12 Allowed Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 168.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.574 ' HB2' HG13 ' A' ' 86' ' ' ILE . 18.4 Cg_exo -40.65 -0.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.218 1 C-N-CA 127.553 5.502 . . . . 0.0 118.977 177.87 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.595 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -34.73 -46.23 0.28 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -156.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.695 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -52.13 -53.71 39.38 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.327 1.06 . . . . 0.0 109.644 174.314 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 34.2 tttp -76.29 -18.02 59.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.046 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.993 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 20.1 mt -60.67 -40.57 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 O-C-N 122.136 -0.352 . . . . 0.0 110.255 175.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 14.8 t -67.04 -19.98 65.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.172 0.51 . . . . 0.0 110.698 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 41.5 mt-10 -78.65 -40.23 34.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.448 0.642 . . . . 0.0 109.836 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.993 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.2 mtmp? -67.83 -30.78 70.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.115 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 69' ' ' ILE . 18.6 mt -66.81 -17.2 64.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.571 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.615 ' HG2' ' HB2' ' A' ' 98' ' ' CYS . 45.1 mtpt -68.71 -14.31 62.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.319 -177.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 89' ' ' LYS . 34.0 mtmm -62.04 -39.27 91.77 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.014 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 94' ' ' ASP . 5.9 mp -91.01 71.73 6.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.58 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 27.9 m-20 72.06 105.21 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.012 -175.487 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.2 m -70.42 -13.54 62.17 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.029 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -49.83 -34.41 19.71 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.926 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.581 HG23 ' HD2' ' A' ' 58' ' ' TYR . 73.3 mt -52.66 -31.14 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.536 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.65 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 5.0 t -86.54 -18.69 30.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.631 -173.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -111.12 52.38 0.74 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.439 0.638 . . . . 0.0 111.322 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.567 HD22 ' OH ' ' A' ' 58' ' ' TYR . 1.5 mp -103.02 -45.05 5.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.889 169.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.684 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 29.6 mmtp 64.33 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.248 -178.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.76 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.4 m-85 . . . . . 0 C--N 1.326 -0.445 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 N--CA 1.445 -1.359 0 N-CA-C 111.117 -0.378 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.901 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -72.33 -37.95 58.79 Favored Glycine 0 N--CA 1.439 -1.112 0 C-N-CA 119.601 -1.285 . . . . 0.0 111.936 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.991 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -173.7 -83.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.413 -176.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -162.67 -67.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.816 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' H ' ' A' ' 12' ' ' GLU . 5.4 m -57.52 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.679 0.612 . . . . 0.0 112.084 -175.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 4.4 tp10 -170.35 -75.98 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.495 0 O-C-N 122.063 -0.398 . . . . 0.0 111.055 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' ' 100' ' ' LEU . 38.9 t -55.6 -43.06 71.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.712 0.767 . . . . 0.0 109.968 179.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' HD21 ' A' ' 55' ' ' LEU . 37.1 t -61.2 -36.16 79.12 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.172 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.64 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 3.2 ptpp? -77.91 -32.84 51.96 Favored 'General case' 0 N--CA 1.458 -0.052 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.11 -177.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 56.9 mm-40 -57.84 -52.5 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.523 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.78 -55.16 32.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.336 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 9' ' ' ALA . 82.9 mt -61.37 -46.08 91.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 121.335 -0.146 . . . . 0.0 111.207 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.901 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.4 t-20 -62.06 -52.95 61.86 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.987 0.179 . . . . 0.0 111.327 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.562 ' NH2' HG22 ' A' ' 48' ' ' THR . 51.1 mtm-85 -65.4 -41.86 93.21 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.562 -177.265 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -59.05 -49.13 79.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.831 0.824 . . . . 0.0 109.584 178.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.537 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 70.0 t80 -53.73 -55.35 27.04 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.256 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -67.39 -34.02 76.41 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.7 m -62.3 -33.9 75.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.933 0.397 . . . . 0.0 111.271 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.6 mp -77.46 -39.83 45.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.35 -45.84 92.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.246 0.546 . . . . 0.0 109.772 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.71 -51.53 68.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.569 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.735 ' HB2' HG12 ' A' ' 30' ' ' VAL . 90.2 mtm-85 -78.25 -13.47 59.84 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.8 25.87 68.51 Favored Glycine 0 CA--C 1.509 -0.322 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 -176.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.744 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 4.0 p -109.28 57.91 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 122.425 1.107 . . . . 0.0 109.683 -173.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.533 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 66.6 t30 -140.7 -179.09 5.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.06 -172.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.8 t80 73.09 -55.84 0.67 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.254 1.021 . . . . 0.0 111.329 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.484 ' O ' HG13 ' A' ' 37' ' ' ILE . 22.3 m -60.52 109.75 1.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.834 0.349 . . . . 0.0 110.644 178.232 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.3 mm? -59.66 -38.88 82.67 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.858 -175.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -61.15 -38.39 86.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.311 0.577 . . . . 0.0 110.626 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 m -76.43 -41.65 46.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.196 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 33' ' ' SER . 61.1 mt -60.44 -32.3 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.13 -50.56 69.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.509 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.1 tptt -62.95 -35.2 79.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.844 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -74.2 -36.74 64.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.67 -178.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.446 HD12 HG23 ' A' ' 74' ' ' THR . 17.1 mt -58.36 -38.78 77.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 172.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.773 HG12 ' HA ' ' A' ' 62' ' ' THR . 96.1 mt -65.43 -49.3 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.905 176.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -63.64 -55.36 24.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.031 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -61.68 -29.45 70.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.666 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.553 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.5 t -54.23 -50.77 66.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 175.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.1 mt -88.42 -14.57 37.68 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.812 0.339 . . . . 0.0 111.833 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -94.93 -1.74 51.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 111.385 -174.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.796 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -85.58 -161.71 0.64 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.856 177.025 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -93.87 169.54 10.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.627 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -46.73 -52.24 11.68 Favored Glycine 0 N--CA 1.453 -0.176 0 O-C-N 123.769 0.668 . . . . 0.0 114.26 -170.569 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -63.72 -39.93 95.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.244 0.522 . . . . 0.0 110.821 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.796 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 50.3 mt-10 -72.21 -31.19 65.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.515 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 74.1 m-20 -66.79 -21.05 66.05 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.667 175.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 7.0 mmm180 -86.01 -44.6 12.18 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.585 HD11 HG23 ' A' ' 97' ' ' ILE . 27.8 tp -59.58 -24.87 64.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.427 -1.26 . . . . 0.0 112.598 -172.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 7.6 p -63.84 -34.85 78.85 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.536 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -74.84 -17.09 60.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.147 0.498 . . . . 0.0 110.003 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.579 ' HB3' HG12 ' A' ' 97' ' ' ILE . 63.0 m-85 -85.41 -51.59 6.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.759 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.29 -46.65 89.42 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.962 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.553 ' O ' ' HA ' ' A' ' 70' ' ' LEU . . . 131.9 59.78 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.968 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -128.85 169.53 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.773 ' HA ' HG12 ' A' ' 42' ' ' ILE . 16.9 p 66.21 142.66 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.295 1.038 . . . . 0.0 111.65 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.448 ' HB3' ' NZ ' ' A' ' 63' ' ' LYS . 9.3 mtpm? -90.73 19.05 5.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -93.12 -27.81 16.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.814 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.81 -167.28 1.39 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.273 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.73 119.93 5.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.055 0.455 . . . . 0.0 110.991 178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.26 -16.16 44.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.667 -176.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 27.5 ttpp -62.73 -51.94 65.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.35 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 72' ' ' GLU . 8.5 tp -65.88 -25.73 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.553 ' HA ' ' O ' ' A' ' 60' ' ' GLY . 2.8 tt -61.4 -45.08 95.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.502 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 45.3 m -66.68 -35.14 79.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.304 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.476 ' HB2' HD12 ' A' ' 69' ' ' ILE . 42.4 mt-10 -68.86 -23.42 64.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.756 -177.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.482 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 91.6 t -88.01 -48.53 15.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.774 0.321 . . . . 0.0 111.371 174.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.446 HG23 HD12 ' A' ' 41' ' ' LEU . 7.9 p -54.02 -47.27 71.7 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -176.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.1 mpt_? -58.09 -53.29 67.45 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.745 -177.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.551 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 52.7 Cg_exo -56.74 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.78 1.654 . . . . 0.0 113.1 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.5 mmt -62.69 -14.05 39.47 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.823 0.344 . . . . 0.0 111.749 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 31.5 t -74.27 -14.87 60.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.262 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.647 HG22 ' H ' ' A' ' 80' ' ' HIS . 4.4 p -136.18 -178.15 2.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.647 ' H ' HG22 ' A' ' 79' ' ' VAL . 60.0 t-80 -56.09 -64.29 0.91 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 117.869 0.304 . . . . 0.0 110.336 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER 67.04 146.39 0.11 Allowed Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 51.7 Cg_exo -41.87 0.99 0.0 OUTLIER 'Trans proline' 0 C--O 1.21 -0.878 1 C-N-CA 126.838 5.025 . . . . 0.0 117.723 167.039 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.567 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.1 -34.53 0.06 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -159.46 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.991 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 1.1 mpp? -55.88 -56.64 18.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.872 0.844 . . . . 0.0 109.559 171.128 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 82' ' ' PRO . 44.4 mttm -68.54 -19.87 64.52 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.616 -1.174 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 83' ' ' ALA . 24.7 mt -60.87 -29.63 45.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.046 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.546 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 46.0 t -72.04 -34.34 68.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.428 0.632 . . . . 0.0 110.026 176.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.596 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 51.0 mt-10 -69.09 -41.12 77.91 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.681 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -76.11 -28.21 57.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.669 177.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 90' ' ' LEU . 6.9 mt -67.63 -28.15 67.48 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.995 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.596 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 25.7 mtpp -60.75 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.958 176.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -79.15 -13.89 59.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.374 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.2 mp -100.21 -49.57 4.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.647 174.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -142.09 118.78 11.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.906 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.2 p -85.65 -15.11 43.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.798 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.13 -29.99 65.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.585 HG23 HD11 ' A' ' 55' ' ' LEU . 95.4 mt -50.87 -40.36 20.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.907 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.426 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 49.6 t -71.36 -52.26 19.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.357 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -97.2 36.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.717 -171.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.597 ' O ' HG21 ' A' ' 13' ' ' VAL . 10.1 tp -84.65 37.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -54.02 145.54 16.51 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.351 -173.449 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo . . . . . 0 N--CA 1.456 -0.73 0 CA-C-O 121.208 0.42 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.841 ' H ' ' HD3' ' A' ' 15' ' ' LYS . . . -73.08 -42.64 43.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.107 -176.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.664 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -166.92 -82.68 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.175 0.512 . . . . 0.0 110.963 -172.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -162.16 -62.53 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.319 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 14' ' ' CYS . 4.8 p -77.76 148.13 34.98 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.24 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -58.91 -72.08 0.11 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -172.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 55' ' ' LEU . 6.1 p -51.38 -48.65 33.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -170.498 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 33.9 t -62.97 -43.18 99.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.924 0.392 . . . . 0.0 110.877 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.841 ' HD3' ' H ' ' A' ' 8' ' ' GLY . 5.2 ptpp? -72.32 -42.13 65.75 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.578 -175.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.61 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 37.0 mm-40 -57.88 -42.73 85.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.535 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -60.0 -51.46 69.57 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.418 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 66.5 mt -60.34 -45.04 94.87 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -50.92 -56.39 12.58 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 123.52 0.512 . . . . 0.0 112.109 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.626 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -58.67 -55.24 37.65 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.719 -177.688 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 69.2 t80 -59.08 -48.22 82.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.203 0.525 . . . . 0.0 111.073 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 46.4 t80 -53.3 -48.41 68.41 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.188 -174.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.413 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -85.69 -39.26 17.42 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.504 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -61.96 -32.44 72.87 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.761 0.315 . . . . 0.0 111.356 -178.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 11.5 tp -61.63 -41.94 98.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.307 0.575 . . . . 0.0 109.992 177.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.3 mm -75.26 -38.06 40.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.455 -177.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.14 -45.91 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.596 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -70.08 -23.7 63.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.051 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.36 -5.58 67.84 Favored Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.985 -0.626 . . . . 0.0 111.657 174.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.752 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -86.48 122.41 38.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.048 -0.576 . . . . 0.0 110.201 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -172.03 -177.99 2.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 174.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.465 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 94.9 m-85 71.19 -58.36 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.628 0.771 . . . . 0.0 112.145 178.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 37' ' ' ILE . 12.5 m -64.2 109.07 1.74 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.847 0.356 . . . . 0.0 110.15 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 75' ' ' ARG . 2.6 mm? -59.86 -37.74 80.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.874 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.08 -36.57 82.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.54 0.686 . . . . 0.0 110.045 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.409 HG22 ' CG2' ' A' ' 30' ' ' VAL . 56.6 m -80.09 -38.78 31.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.49 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 33' ' ' SER . 72.1 mt -62.89 -34.75 67.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -72.96 -38.74 66.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.554 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -58.49 -47.73 83.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 175.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.635 ' HG3' HG21 ' A' ' 30' ' ' VAL . 6.7 mm-40 -68.47 -41.42 80.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.526 -176.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.563 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 13.6 mt -55.79 -44.9 78.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 175.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.486 HD13 ' HD3' ' A' ' 63' ' ' LYS . 69.1 mt -62.7 -52.41 60.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.138 178.282 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.1 m -58.94 -47.34 85.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.959 0.409 . . . . 0.0 111.21 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.626 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 30.2 t80 -65.84 -36.25 82.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.746 -176.33 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 6.5 m -69.33 -33.29 72.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.8 mt -85.29 -31.7 22.92 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.373 -0.531 . . . . 0.0 109.938 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.25 70.02 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.72 0.771 . . . . 0.0 110.305 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -159.1 -162.33 1.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.284 177.662 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.64 170.41 9.35 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.286 -0.566 . . . . 0.0 111.145 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.53 -48.37 60.8 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.174 -169.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 11.5 mptt -67.44 -25.74 66.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.448 0.624 . . . . 0.0 111.562 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.45 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 36.5 mt-10 -77.97 -49.38 14.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -58.16 -40.59 81.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.467 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 54' ' ' ARG . 27.2 tpt85 -69.97 -40.35 75.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.214 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 13' ' ' VAL . 43.8 tp -61.25 -34.09 74.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.092 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 64.4 m -68.41 -14.71 63.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -67.7 -29.32 68.55 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -85.54 -39.3 17.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.092 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 66.8 mt -67.33 -31.93 72.54 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.183 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.523 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 109.31 -18.13 30.79 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.873 176.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.533 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -80.58 67.46 6.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.457 0.646 . . . . 0.0 111.393 -177.338 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 64' ' ' ASP . 25.0 m -155.15 145.7 22.17 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HD3' HD13 ' A' ' 42' ' ' ILE . 31.9 mmmt -76.46 2.97 12.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.261 0.553 . . . . 0.0 110.858 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.533 ' H ' HG22 ' A' ' 62' ' ' THR . 19.9 m-20 -125.27 29.34 6.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.334 171.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.28 170.84 14.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.464 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.51 117.46 18.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.047 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . 39.7 p -73.37 -14.1 61.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.712 -178.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -58.67 -56.33 23.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.62 0.248 . . . . 0.0 110.728 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.523 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.5 tt -69.23 -25.73 30.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.042 0.449 . . . . 0.0 110.377 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 67' ' ' THR . 20.2 tp -60.24 -48.67 80.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.686 174.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 20.8 m -66.05 -29.28 69.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.41 -21.43 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.965 175.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 57.3 t -87.65 -45.0 16.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.809 0.338 . . . . 0.0 111.35 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 28.7 p -57.72 -41.5 81.88 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.579 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.5 mpt_? -59.01 -54.97 51.22 Favored Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.611 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.586 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 50.5 Cg_exo -56.6 -43.13 58.03 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.946 1.764 . . . . 0.0 113.24 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.3 mmt -62.91 -13.75 38.25 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.465 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 40.6 t -69.64 -12.31 61.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.574 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -153.73 -166.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.786 ' H ' HG22 ' A' ' 79' ' ' VAL . 36.9 t60 -60.54 -71.8 0.13 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.886 0.312 . . . . 0.0 110.911 -176.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.762 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 48.8 mmm 64.24 158.0 0.12 Allowed Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 170.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.762 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 52.1 Cg_exo -41.26 1.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.033 1 C-N-CA 128.4 6.067 . . . . 0.0 118.92 172.257 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.639 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.39 -24.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -162.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.652 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -67.96 -58.88 3.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.44 1.018 . . . . 0.0 109.963 173.233 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 64.0 pttt -76.62 -12.14 59.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 -176.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.682 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 16.8 mt -54.52 -35.23 31.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 173.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.481 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 48.8 t -71.34 -29.11 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.166 0.508 . . . . 0.0 110.319 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.654 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 9.0 tp10 -70.8 -38.5 73.34 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.562 0.696 . . . . 0.0 109.144 174.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.09 -20.94 64.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.119 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 69' ' ' ILE . 79.9 mt -78.87 -34.18 45.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.958 173.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.658 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 48.7 mtpt -62.91 -27.3 69.28 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.449 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -60.02 -29.23 68.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.627 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -96.4 -50.88 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.086 0.47 . . . . 0.0 110.258 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.658 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 12.5 t70 -134.57 123.5 23.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.3 m -86.2 -15.28 41.41 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -86.07 -25.66 25.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.171 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 94' ' ' ASP . 14.7 tt -55.47 -31.52 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 121.198 0.523 . . . . 0.0 110.89 178.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 91' ' ' LYS . 6.6 t -75.7 -55.73 5.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.364 0.602 . . . . 0.0 109.509 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -91.07 49.48 1.64 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.225 -176.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.66 ' HB3' HG11 ' A' ' 13' ' ' VAL . 0.6 OUTLIER -76.23 -47.85 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 176.8 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.447 ' H ' ' CG1' ' A' ' 13' ' ' VAL . 71.2 mmtt 66.37 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.532 0.733 . . . . 0.0 111.687 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' TYR . . . . . 0.794 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 96.9 m-85 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.576 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 4.8 Cg_endo . . . . . 0 N--CA 1.455 -0.781 0 CA-C-O 121.113 0.38 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -75.87 -26.96 63.54 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.33 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . 177.12 -130.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 123.337 0.655 . . . . 0.0 109.421 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -132.81 -47.2 0.87 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.84 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 48.2 m -77.69 21.25 0.3 Allowed 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.377 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.664 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 34.3 tt0 71.4 -67.56 0.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 174.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.745 HG12 HD22 ' A' ' 55' ' ' LEU . 43.8 t -63.28 -55.66 21.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -170.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.782 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.4 p -64.33 -31.1 72.17 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 12.7 ttmt -58.88 -53.9 53.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.5 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 50.2 mm-40 -49.68 -54.67 17.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.655 176.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.32 -54.4 47.39 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.092 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.799 HD11 ' HB2' ' A' ' 87' ' ' CYS . 96.3 mt -57.44 -53.93 52.61 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.704 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -70.61 -43.36 69.47 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.854 -173.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.577 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 46.7 mtp180 -61.33 -41.23 96.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.195 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.466 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 41.1 t80 -59.47 -49.25 78.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.968 0.889 . . . . 0.0 109.631 175.204 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.588 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 25.7 t80 -58.05 -55.57 33.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.762 -1.563 . . . . 0.0 111.801 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -67.14 -27.72 67.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.714 0.293 . . . . 0.0 110.997 -176.149 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 17.0 t -68.82 -46.13 69.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.632 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -56.85 -52.84 63.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.913 -179.57 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.55 -40.29 88.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.386 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -69.28 -40.24 77.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.033 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -62.55 -31.53 72.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.965 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.3 8.92 40.14 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 174.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.514 HG23 ' N ' ' A' ' 31' ' ' ASN . 5.1 m -89.59 -154.98 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.964 -0.618 . . . . 0.0 109.539 179.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 1.106 ' HA ' HD11 ' A' ' 37' ' ' ILE . 15.8 t30 78.94 91.55 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.747 0.784 . . . . 0.0 112.984 168.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.516 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 17.8 t80 166.45 -30.39 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.682 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG12 ' A' ' 37' ' ' ILE . 13.4 m -87.98 117.24 26.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.692 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.666 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.1 mm? -63.69 -41.04 98.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.307 -172.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.63 -25.89 65.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 89.7 m -78.97 -43.98 23.36 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.86 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 1.106 HD11 ' HA ' ' A' ' 31' ' ' ASN . 47.2 mm -58.61 -31.05 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG3' HD11 ' A' ' 70' ' ' LEU . 28.3 tt0 -57.33 -47.77 80.71 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.563 174.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.58 ' HD2' HD12 ' A' ' 42' ' ' ILE . 14.0 mmmm -76.5 -35.2 58.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.921 -178.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' HD11 ' A' ' 25' ' ' LEU . 23.8 mm-40 -62.18 -40.72 96.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.305 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.411 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 19.4 mt -58.9 -33.16 70.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.819 HG12 ' H ' ' A' ' 62' ' ' THR . 76.9 mt -74.64 -46.89 40.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.671 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.9 t -61.89 -47.54 84.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.361 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 32.1 t80 -68.31 -27.88 66.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.364 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 20.3 t -61.08 -28.97 69.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.004 0.43 . . . . 0.0 110.603 174.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -85.98 -42.04 14.35 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -78.17 49.07 0.79 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.03 0.443 . . . . 0.0 111.512 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.816 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -144.34 -173.54 4.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.971 178.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.69 175.85 5.51 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 121.211 -0.196 . . . . 0.0 110.626 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.66 -53.55 12.9 Favored Glycine 0 CA--C 1.522 0.477 0 N-CA-C 114.966 0.747 . . . . 0.0 114.966 -170.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -67.02 -29.56 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 117.62 0.71 . . . . 0.0 110.687 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.816 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 71.6 mt-10 -80.63 -36.25 32.88 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.513 -176.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -61.08 -53.33 58.41 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 173.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -57.91 -34.64 70.05 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.842 178.061 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.782 HD21 ' HA ' ' A' ' 14' ' ' CYS . 42.7 tp -60.93 -32.69 72.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.43 -175.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 10.3 p -66.94 -21.09 65.99 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.612 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -71.02 -22.96 62.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.127 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.596 ' HB3' HG12 ' A' ' 97' ' ' ILE . 97.3 m-85 -80.47 -35.21 35.16 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.45 -5.53 58.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.844 -179.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 95.17 17.96 35.45 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.992 170.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.402 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -89.31 -179.29 5.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.227 0.513 . . . . 0.0 111.414 -177.445 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.819 ' H ' HG12 ' A' ' 42' ' ' ILE . 63.2 p 59.6 15.83 4.91 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.531 1.132 . . . . 0.0 113.288 177.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 61.23 -178.94 0.11 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 122.604 0.362 . . . . 0.0 110.903 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.7 t70 71.74 -47.82 0.67 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.435 0.694 . . . . 0.0 110.974 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.27 155.92 27.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.78 112.85 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.889 0.376 . . . . 0.0 111.186 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.0 p -64.9 -14.13 58.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.532 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -49.36 -50.92 37.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 58' ' ' TYR . 18.6 tt -80.67 -24.39 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.699 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.565 HD11 ' HG3' ' A' ' 38' ' ' GLU . 3.4 tm? -57.04 -48.47 78.45 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.607 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 7.8 p -69.56 -35.16 75.14 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.853 177.122 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.46 -32.62 71.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.784 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . 0.403 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 96.9 t -85.85 -47.08 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.503 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.509 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 7.4 p -55.44 -46.76 76.7 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.666 ' HA ' HD11 ' A' ' 34' ' ' LEU . 3.5 mpt_? -56.38 -56.72 28.75 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.949 -177.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.52 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 72.4 Cg_endo -75.26 -13.77 20.79 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 121.465 1.444 . . . . 0.0 113.836 -177.237 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.2 mmt -74.9 -33.22 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.067 0.46 . . . . 0.0 109.794 172.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.1 m -68.88 -14.5 63.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.561 -173.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.717 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.5 p -139.53 149.53 22.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.588 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 2.0 t60 -58.04 105.32 0.26 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -177.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.717 ' HG3' HG13 ' A' ' 79' ' ' VAL . 45.7 mtp -141.07 174.24 4.09 Favored Pre-proline 0 CA--C 1.541 0.606 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -169.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.64 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.9 Cg_endo -40.83 2.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.114 1 C-N-CA 128.301 6.001 . . . . 0.0 118.97 177.305 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . 0.58 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.74 -44.0 0.32 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -159.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.633 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -59.66 -37.62 79.23 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.033 0.833 . . . . 0.0 110.931 177.331 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 38.0 ttpt -84.81 -17.78 37.03 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.978 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 44.9 mt -61.8 -41.66 91.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.407 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' CYS . . . . . 0.799 ' HB2' HD11 ' A' ' 18' ' ' LEU . 46.6 t -64.65 -27.43 68.92 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.66 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 33.7 tt0 -70.06 -31.34 68.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.381 0.61 . . . . 0.0 109.57 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 53.7 mtmt -78.84 -28.61 44.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.92 174.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 88.0 mt -68.4 -23.85 64.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.298 176.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 50.6 mtpt -62.1 -25.04 67.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -75.25 -34.25 61.37 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.31 -52.14 36.94 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.743 ' HB3' HG13 ' A' ' 97' ' ' ILE . 29.2 t0 -160.7 124.61 3.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.263 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.6 m -74.24 -17.96 60.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.083 -176.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.0 tp60 -76.13 -14.04 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.081 0.467 . . . . 0.0 110.446 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.743 HG13 ' HB3' ' A' ' 94' ' ' ASP . 65.6 mt -67.12 -22.76 29.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.502 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 11' ' ' CYS . 14.2 p -117.52 -38.42 3.31 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.492 -176.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -85.11 56.87 4.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.571 ' HB2' HG21 ' A' ' 13' ' ' VAL . 6.1 mp -85.21 -49.37 8.27 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 174.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.7 mmtt 68.55 130.61 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 O-C-N 124.035 0.834 . . . . 0.0 112.079 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.167 -177.983 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 . . . . . 0 N--CA 1.482 1.147 0 CA-C-O 120.509 0.195 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 65.3 -169.87 0.2 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.347 169.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.42 147.22 14.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.809 -1.087 . . . . 0.0 108.598 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.48 109.4 2.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.578 -175.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 108.88 -8.48 33.88 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.199 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.401 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 26.0 mmt85 53.41 66.01 5.09 Favored Pre-proline 0 N--CA 1.466 0.335 0 CA-C-O 120.913 0.387 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 25.3 Cg_endo -93.8 55.46 0.36 Allowed 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 123.34 2.693 . . . . 0.0 110.807 178.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.992 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -70.09 -50.83 26.2 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.544 -172.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.868 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -174.1 -91.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -169.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -134.75 -80.7 0.44 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -71.14 -88.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.38 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 36.9 tt0 -163.64 -77.83 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.553 0 O-C-N 122.315 -0.24 . . . . 0.0 110.563 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.813 HG12 HD22 ' A' ' 55' ' ' LEU . 46.6 t -56.95 -40.36 71.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.685 ' HA ' HD21 ' A' ' 55' ' ' LEU . 35.8 t -59.78 -40.68 89.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.085 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.715 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 15.2 ptpt -75.97 -42.54 48.09 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.624 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 4.7 mm-40 -65.74 -40.9 92.6 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.006 -176.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -62.15 -54.82 35.72 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.62 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 95.5 mt -57.84 -52.74 64.21 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 122.957 0.161 . . . . 0.0 110.772 -177.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.992 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -60.14 -51.3 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 123.125 0.266 . . . . 0.0 111.391 -176.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 20' ' ' ARG . 23.4 mtm180 -67.58 -39.37 84.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.218 -175.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -64.2 -41.76 96.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 122.086 0.946 . . . . 0.0 109.667 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.706 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 14.5 t80 -64.81 -55.7 18.04 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.722 -173.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -76.16 -19.33 58.56 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.998 -176.831 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 t -64.59 -55.19 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.013 174.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.611 ' HA ' HG13 ' A' ' 30' ' ' VAL . 3.4 mp -59.74 -40.32 87.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.508 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 22' ' ' TYR . 51.4 mm -64.27 -43.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -74.82 -43.74 53.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.461 -177.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.802 ' HB2' HG12 ' A' ' 30' ' ' VAL . 16.2 mtm180 -67.79 -14.38 62.91 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.007 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.19 28.4 66.33 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 28' ' ' ARG . 3.4 p -111.93 51.81 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 CA-C-O 122.761 1.267 . . . . 0.0 109.27 -175.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.458 ' OD1' ' HA ' ' A' ' 78' ' ' SER . 9.2 t-20 -145.09 -167.32 2.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.318 -177.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.44 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 95.8 m-85 68.67 4.59 4.45 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.575 0.75 . . . . 0.0 111.139 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 15.5 m -128.47 107.35 9.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.255 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.064 -173.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -68.72 -32.75 72.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.238 0.542 . . . . 0.0 110.492 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.478 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 55.3 m -73.11 -42.16 63.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' SER . 53.7 mt -59.27 -32.97 49.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.25 0.547 . . . . 0.0 109.543 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -68.43 -44.16 75.56 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 42' ' ' ILE . 47.5 tptt -69.91 -39.06 76.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.682 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.82 -28.31 62.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.904 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.39 -46.87 82.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 168.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 39' ' ' LYS . 82.5 mt -56.06 -52.11 54.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 176.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.5 m -57.14 -55.66 31.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.714 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.88 -39.4 83.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.084 -173.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 56.9 m -62.93 -39.35 94.32 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.35 -29.4 24.51 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.494 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -92.23 58.71 3.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.709 0.766 . . . . 0.0 110.582 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.98 -164.94 1.98 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.295 179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -98.11 167.33 10.95 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.398 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.99 -40.14 19.7 Favored Glycine 0 C--N 1.333 0.382 0 O-C-N 123.839 0.712 . . . . 0.0 114.298 -170.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 5.0 mptp? -51.86 -48.48 63.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.919 0.39 . . . . 0.0 111.221 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -82.99 -35.44 25.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.198 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 9.0 m-20 -62.59 -33.95 76.0 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.56 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 23.5 tpt180 -83.42 -38.96 21.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.851 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 HG12 ' A' ' 13' ' ' VAL . 19.7 tp -55.34 -39.53 70.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.316 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.76 -23.05 65.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 45.6 m-85 -61.78 -27.15 68.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.614 176.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.475 ' HB3' HG12 ' A' ' 97' ' ' ILE . 62.0 m-85 -86.33 -19.96 29.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.85 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.7 mt -102.2 -22.5 14.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.365 -174.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 124.73 -128.56 6.76 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.205 -0.522 . . . . 0.0 111.822 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.766 ' H ' ' HG ' ' A' ' 70' ' ' LEU . . . 57.24 -167.72 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 112.201 175.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 58.3 p 56.68 11.04 0.8 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.085 0.954 . . . . 0.0 112.922 177.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt 60.8 13.98 4.81 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.879 0.472 . . . . 0.0 111.467 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' HB3' ' H ' ' A' ' 65' ' ' ALA . 3.4 m-20 -151.28 -161.65 1.38 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.088 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . 70.94 -84.03 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 O-C-N 123.817 0.698 . . . . 0.0 111.38 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.02 104.48 5.25 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.92 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.5 p -83.84 -26.31 29.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -77.09 -47.28 20.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.029 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.1 tt -64.7 -21.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.766 ' HG ' ' H ' ' A' ' 61' ' ' ALA . 2.7 tt -55.06 -44.84 75.15 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.075 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.609 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 81.8 p -65.4 -29.57 70.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -74.19 -14.04 60.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.039 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 52.9 t -88.25 -55.88 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.186 0.517 . . . . 0.0 110.615 171.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.403 HG22 HG22 ' A' ' 37' ' ' ILE . 34.4 p -58.25 -42.51 86.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.579 -173.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.609 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.1 mpt_? -59.14 -55.1 49.81 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.474 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 50.4 Cg_endo -72.18 -14.41 28.68 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.52 1.48 . . . . 0.0 113.17 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -14.09 59.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.806 0.336 . . . . 0.0 110.51 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.458 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 43.6 t -80.9 -13.67 58.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.774 -177.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.73 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.2 p -146.36 149.53 15.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -175.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.706 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 5.7 t60 -60.38 107.78 0.71 Allowed 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.73 ' HG3' HG13 ' A' ' 79' ' ' VAL . 34.6 mtp -140.68 170.36 9.7 Favored Pre-proline 0 CA--C 1.533 0.317 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -167.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.498 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 23.8 Cg_exo -41.25 2.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.865 1 C-N-CA 128.149 5.899 . . . . 0.0 119.125 174.447 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.6 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.5 -24.37 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 -166.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.868 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -65.2 -57.44 8.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.819 0.819 . . . . 0.0 109.477 170.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.7 ttpt -70.27 -14.45 62.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.732 179.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 83' ' ' ALA . 38.2 mt -66.12 -27.09 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 122.06 -0.4 . . . . 0.0 110.539 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.685 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 50.8 t -75.61 -22.87 56.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.611 0.72 . . . . 0.0 109.65 175.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.8 mt-10 -75.64 -38.41 58.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.168 173.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -62.65 -35.99 81.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.647 171.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 87' ' ' CYS . 21.4 mt -61.81 -28.68 69.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.313 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.589 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.7 mmmm -65.85 -24.06 66.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.602 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -81.69 -14.63 56.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.924 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.548 HD12 HD23 ' A' ' 90' ' ' LEU . 96.3 mt -94.37 -39.83 10.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.163 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -162.38 137.47 7.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.974 175.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 41.7 t -85.07 -21.92 29.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.163 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -68.59 -19.71 64.47 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.829 0.347 . . . . 0.0 110.844 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' HB3' ' A' ' 58' ' ' TYR . 51.7 mt -61.0 -30.17 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.305 0.574 . . . . 0.0 110.283 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.589 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 44.3 t -85.96 79.72 9.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.167 176.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 179.37 -139.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.896 174.015 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.557 ' O ' HG21 ' A' ' 13' ' ' VAL . 6.7 mp 63.63 21.98 12.95 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.739 0.649 . . . . 0.0 111.131 177.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.441 ' HG2' ' OE1' ' A' ' 99' ' ' GLU . 33.4 mmtp -46.15 134.53 8.39 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 123.729 0.643 . . . . 0.0 112.078 -170.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.598 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.0 m-85 -54.19 -59.29 4.85 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 123.388 0.43 . . . . 0.0 110.934 -174.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -136.67 91.7 2.68 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.652 ' HD3' ' H ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -77.3 -29.32 53.67 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 160.565 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-N 113.989 -1.46 . . . . 0.0 111.33 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.601 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 16.6 mm-40 . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 1' ' ' GLN . 5.2 pt-20 62.19 157.38 0.05 Allowed 'General case' 0 N--CA 1.474 0.745 0 O-C-N 124.732 1.27 . . . . 0.0 113.238 174.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.644 ' HB2' ' HG2' ' A' ' 23' ' ' LYS . . . -109.27 143.16 39.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.159 173.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.03 111.0 2.74 Favored Glycine 0 N--CA 1.452 -0.25 0 O-C-N 123.662 0.601 . . . . 0.0 113.185 -174.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 117.32 -16.58 12.8 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.453 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.575 ' HD2' ' OE1' ' A' ' 16' ' ' GLU . 13.2 mmt180 54.72 55.32 11.2 Favored Pre-proline 0 N--CA 1.467 0.408 0 C-N-CA 122.529 0.331 . . . . 0.0 111.804 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 22.1 Cg_endo -97.04 71.05 0.11 Allowed 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.397 2.731 . . . . 0.0 112.223 -177.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -85.78 -37.46 9.41 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.818 -1.182 . . . . 0.0 112.271 -177.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LYS . . . 175.33 -109.54 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.19 0.596 . . . . 0.0 109.879 -174.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -149.85 -35.22 0.17 Allowed 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 172.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 91.8 m -67.67 101.98 1.12 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.982 0.42 . . . . 0.0 109.943 173.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 39.3 tt0 -46.3 -59.9 2.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.645 -1.161 . . . . 0.0 113.895 -165.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.967 HG12 HD22 ' A' ' 55' ' ' LEU . 23.1 t -64.11 -47.97 87.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.356 0.598 . . . . 0.0 110.839 -176.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.8 ' HB2' HG22 ' A' ' 97' ' ' ILE . 5.1 t -59.22 -47.07 86.69 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.649 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 10.3 ptmm? -64.81 -38.29 90.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.308 -176.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.682 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 15.8 mm-40 -65.02 -42.9 93.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.605 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -62.61 -51.41 67.41 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.624 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 58.2 mt -62.39 -54.81 34.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.738 -176.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.644 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 28.5 t-20 -58.18 -45.61 87.22 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.271 0.357 . . . . 0.0 111.843 -174.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HG2' ' HA ' ' A' ' 2' ' ' GLU . 87.0 mtm180 -64.11 -50.18 69.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.838 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -55.64 -47.65 76.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.328 1.061 . . . . 0.0 110.185 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.717 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 3.2 t80 -56.89 -52.14 66.32 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.807 -1.997 . . . . 0.0 112.412 -171.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.644 ' HG2' ' HB2' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -83.46 -23.83 32.06 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.966 -177.017 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.639 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 42.6 m -57.02 -44.14 82.56 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.645 176.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 4.2 mp -63.91 -28.23 69.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.534 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 50.4 mm -71.63 -46.51 62.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 176.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.17 -46.9 81.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.859 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.86 ' HG3' HG23 ' A' ' 30' ' ' VAL . 20.5 ptp180 -85.31 -13.76 48.64 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.93 49.95 5.41 Favored Glycine 0 C--O 1.228 -0.239 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.439 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.011 HG13 HG22 ' A' ' 36' ' ' THR . 59.0 t -118.71 3.46 7.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.688 1.232 . . . . 0.0 110.338 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 31' ' ' ASN . 1.0 OUTLIER -96.92 174.49 6.76 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.303 -170.508 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 68.38 9.51 7.3 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.875 0.734 . . . . 0.0 112.018 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.465 ' O ' HG13 ' A' ' 37' ' ' ILE . 41.6 m -136.99 110.15 7.78 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.47 -35.14 75.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.313 -172.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.2 -36.24 74.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.375 0.607 . . . . 0.0 110.361 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 1.011 HG22 HG13 ' A' ' 30' ' ' VAL . 19.1 m -74.16 -39.87 62.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.494 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.501 HG22 HG22 ' A' ' 74' ' ' THR . 78.7 mt -61.37 -34.36 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.36 173.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.91 -50.33 69.15 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.909 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -62.28 -42.15 99.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.708 -176.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.535 ' HG3' HG11 ' A' ' 30' ' ' VAL . 26.9 mm-40 -80.68 -16.78 53.09 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.503 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.59 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.3 tp -68.87 -41.23 78.67 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 172.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 1.7 mp -66.42 -41.44 88.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.46 173.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 32.2 t -64.03 -56.1 17.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.632 ' HA ' ' HB3' ' A' ' 47' ' ' ASP . 22.2 t80 -62.73 -28.78 70.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.223 0.535 . . . . 0.0 109.982 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 42' ' ' ILE . 53.8 t -49.2 -52.28 27.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.628 174.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.6 mt -89.55 -18.37 26.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.776 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.632 ' HB3' ' HA ' ' A' ' 44' ' ' PHE . 27.6 t70 -63.83 -29.16 70.38 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 111.173 -177.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.683 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -73.5 -169.63 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.945 177.132 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -100.37 173.44 6.59 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.365 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -45.56 -41.63 9.51 Favored Glycine 0 C--N 1.332 0.359 0 O-C-N 123.961 0.788 . . . . 0.0 114.453 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -59.45 -53.63 55.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.889 0.345 . . . . 0.0 111.177 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.683 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 2.1 mp0 -75.72 -27.66 58.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.467 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -61.42 -40.46 94.49 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -69.93 -43.42 71.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.197 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.967 HD22 HG12 ' A' ' 13' ' ' VAL . 23.9 tp -55.77 -35.81 66.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.941 178.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.97 -28.14 69.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.084 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -63.88 -31.94 73.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.153 0.501 . . . . 0.0 109.945 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -83.55 -23.21 32.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.357 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.95 -7.69 56.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.987 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.462 ' HA2' ' HB1' ' A' ' 65' ' ' ALA . . . 72.53 43.69 43.61 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.239 -0.891 . . . . 0.0 113.735 171.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.59 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -127.98 23.07 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.499 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -113.02 -117.76 0.31 Allowed 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.092 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.499 ' H ' ' HB ' ' A' ' 62' ' ' THR . 55.7 mtpt -129.05 142.73 50.81 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 60.88 31.42 20.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.723 0.773 . . . . 0.0 109.842 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB1' ' HA2' ' A' ' 60' ' ' GLY . . . -104.23 -178.54 3.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.621 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.508 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -69.39 119.85 14.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.4 p -70.32 -28.02 64.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -72.0 -45.73 59.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.125 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.777 HD11 HD11 ' A' ' 90' ' ' LEU . 14.6 tt -66.03 -28.76 44.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.443 -175.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.463 HD12 HD23 ' A' ' 41' ' ' LEU . 46.5 tp -57.13 -45.53 83.44 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.373 0.606 . . . . 0.0 110.419 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.653 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 17.0 m -71.87 -37.48 70.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.246 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -64.33 -22.9 67.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.967 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 69' ' ' ILE . 94.3 t -86.19 -47.74 16.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.864 174.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.501 HG22 HG22 ' A' ' 37' ' ' ILE . 11.6 p -58.27 -33.64 69.62 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 71' ' ' SER . 5.5 mtt180 -67.29 -55.39 15.55 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.607 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 29.2 Cg_endo -67.34 -16.79 48.86 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.261 1.308 . . . . 0.0 113.01 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.6 mmt -78.2 -14.41 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.641 0.257 . . . . 0.0 111.002 175.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -79.89 -14.73 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.669 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.7 p -150.06 150.09 13.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -176.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.717 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 7.5 t60 -60.9 110.72 1.41 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.182 0.515 . . . . 0.0 110.122 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.669 ' HG3' HG13 ' A' ' 79' ' ' VAL . 48.2 mtp -137.6 173.73 5.11 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.345 -167.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.549 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 2.6 Cg_endo -40.64 0.9 0.0 OUTLIER 'Trans proline' 0 C--O 1.206 -1.081 1 C-N-CA 127.853 5.702 . . . . 0.0 118.863 175.53 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.591 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.41 -32.31 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.809 1.781 . . . . 0.0 115.809 -161.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 1.5 mtm -54.24 -48.05 71.54 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.965 0.888 . . . . 0.0 109.971 171.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 82' ' ' PRO . 3.1 mptp? -70.34 -29.95 66.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.677 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.591 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 50.2 mt -64.71 -29.73 48.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.052 0.453 . . . . 0.0 110.184 -174.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 52.6 t -61.28 -39.75 91.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.307 0.575 . . . . 0.0 109.993 172.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.51 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 15.8 mm-40 -72.05 -22.28 61.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.742 176.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -72.18 -38.87 69.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.777 HD11 HD11 ' A' ' 69' ' ' ILE . 2.8 mm? -66.76 -27.24 67.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.629 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.585 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.0 mmmm -63.51 -23.26 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.866 176.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -77.5 -17.45 57.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.778 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 mp -95.31 -40.87 9.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.608 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -164.32 135.31 4.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.796 0.332 . . . . 0.0 110.695 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.7 m -86.26 -15.48 40.61 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -67.63 -21.67 65.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.246 0.546 . . . . 0.0 110.341 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.8 HG22 ' HB2' ' A' ' 14' ' ' CYS . 57.3 mt -61.87 -23.58 31.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.33 176.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.585 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 24.2 t -89.43 -48.29 7.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.991 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -102.95 21.81 15.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.913 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.95 -42.91 99.65 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.461 ' HD3' ' HA ' ' A' ' 101' ' ' LYS . 60.7 mmtt 63.79 163.3 0.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.55 -1.205 . . . . 0.0 113.883 174.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -107.79 -154.95 0.54 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.789 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 103' ' ' GLU . 4.3 mp0 -63.09 -82.02 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.21 177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.523 ' HG2' ' H ' ' A' ' 105' ' ' THR . 14.7 ttmm 54.47 -150.79 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.248 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.523 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 7.4 t . . . . . 0 C--O 1.25 1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 112.84 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 120.472 0.177 . . . . 0.0 110.588 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 66.0 -91.42 0.03 OUTLIER 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.496 0.718 . . . . 0.0 111.416 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.06 -176.76 4.98 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.086 0.469 . . . . 0.0 111.597 -176.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 100.98 35.69 4.17 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -174.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.27 20.43 57.07 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.034 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.487 ' O ' ' HD2' ' A' ' 15' ' ' LYS . 18.0 mmm180 51.55 71.1 1.61 Allowed Pre-proline 0 N--CA 1.467 0.386 0 C-N-CA 122.74 0.416 . . . . 0.0 110.822 -176.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -90.28 69.85 1.61 Allowed 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 123.379 2.719 . . . . 0.0 111.207 -175.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.93 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -84.39 -26.18 40.61 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.808 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.598 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . -172.31 -83.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.119 0.485 . . . . 0.0 111.039 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t70 176.02 -27.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 5.4 m -73.09 -147.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.095 169.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . 35.5 tt0 -130.34 -73.84 0.55 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.117 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.932 HG12 HD22 ' A' ' 55' ' ' LEU . 93.8 t -60.48 -47.92 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.498 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.675 ' HA ' HD21 ' A' ' 55' ' ' LEU . 41.9 t -58.56 -37.69 76.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.185 0.517 . . . . 0.0 110.154 174.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.716 ' HG3' ' CA ' ' A' ' 8' ' ' GLY . 27.7 ttpt -64.65 -55.55 19.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.847 -179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 61.9 mm-40 -58.94 -44.89 91.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.898 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -58.02 -56.66 19.18 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.237 0.335 . . . . 0.0 111.717 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 87' ' ' CYS . 97.9 mt -60.1 -48.32 82.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.722 0.296 . . . . 0.0 111.022 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.93 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.0 t-20 -67.06 -41.72 85.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.355 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -78.05 -34.26 50.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.925 -175.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.46 -47.04 87.52 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.825 0.821 . . . . 0.0 109.246 172.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.725 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.6 t80 -56.59 -49.88 73.6 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 113.604 -1.635 . . . . 0.0 111.22 -177.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -71.57 -31.7 67.26 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.319 -179.418 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.506 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 73.1 m -60.16 -38.33 82.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.383 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CG2' ' A' ' 30' ' ' VAL . 4.3 mp -73.73 -22.46 59.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.011 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 46.9 mm -80.35 -43.81 21.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.03 -55.18 35.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.806 174.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -78.93 -14.72 59.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.892 -175.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.24 31.66 74.91 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.765 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.662 ' CG2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 m -99.01 3.38 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 122.044 0.926 . . . . 0.0 110.47 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 63.6 t30 -83.62 174.15 10.78 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.093 -169.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.2 t80 75.39 -11.03 1.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.006 0.923 . . . . 0.0 110.795 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 37' ' ' ILE . 24.2 m -100.47 105.41 16.86 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.616 HD21 ' HE ' ' A' ' 75' ' ' ARG . 12.3 tp -62.78 -38.04 89.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.812 -171.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -63.0 -42.04 99.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.401 0.619 . . . . 0.0 110.215 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.7 m -67.27 -38.86 85.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.275 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 33' ' ' SER . 73.9 mt -58.18 -34.17 48.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.724 0.297 . . . . 0.0 110.284 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HG3' ' CD2' ' A' ' 70' ' ' LEU . 35.8 tt0 -69.1 -45.26 70.67 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.463 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -62.94 -40.0 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.195 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.569 ' HG3' HG21 ' A' ' 30' ' ' VAL . 10.0 mm-40 -68.65 -39.39 80.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.309 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.639 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 17.9 mt -55.62 -55.64 29.66 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 120.767 0.318 . . . . 0.0 110.144 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.582 HD11 HD11 ' A' ' 70' ' ' LEU . 1.7 mp -57.47 -46.13 85.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.997 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -61.34 -51.09 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.491 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -61.88 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.068 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.8 m -65.4 -28.59 69.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.521 -178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -86.62 -49.26 7.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -82.32 63.8 6.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.424 0.631 . . . . 0.0 111.067 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.401 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -150.92 -161.45 1.34 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.693 178.644 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HG2' ' OE1' ' A' ' 52' ' ' GLU . 13.2 pttm -103.18 166.86 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 121.081 -0.248 . . . . 0.0 111.241 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.36 -43.48 26.96 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 124.068 0.855 . . . . 0.0 114.398 -170.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.811 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.0 mptt -58.37 -47.69 83.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.234 0.517 . . . . 0.0 111.249 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.408 ' OE1' ' HG2' ' A' ' 49' ' ' LYS . 40.7 mt-10 -71.82 -41.08 68.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.507 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 45.8 m-20 -58.09 -44.18 87.49 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -70.01 -41.86 73.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.871 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.932 HD22 HG12 ' A' ' 13' ' ' VAL . 23.5 tp -53.62 -42.78 68.09 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.691 -177.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 86.2 m -67.34 -14.13 62.64 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -72.31 -25.73 61.68 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.543 ' HB3' HG12 ' A' ' 97' ' ' ILE . 77.0 m-85 -84.99 -40.25 17.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.75 175.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 82.5 mt -74.08 -18.8 60.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.39 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.05 -13.5 63.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.293 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -85.59 75.44 10.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.21 0.529 . . . . 0.0 111.582 -176.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.582 HG22 ' H ' ' A' ' 63' ' ' LYS . 5.8 m -152.78 176.77 11.43 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.582 ' H ' HG22 ' A' ' 62' ' ' THR . 29.4 mtpp -63.17 -37.69 88.21 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.63 -152.69 0.32 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.201 -0.908 . . . . 0.0 109.21 174.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.52 -164.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 112.201 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.75 126.8 34.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.567 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.4 p -86.18 -21.16 27.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.993 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -81.28 -44.92 17.01 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.361 -175.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.485 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 13.9 tt -63.33 -24.61 36.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.428 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 42' ' ' ILE . 3.3 tt -60.14 -44.25 95.09 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 174.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.646 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 19.0 m -66.51 -18.87 65.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.01 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 27.8 mm-40 -71.62 -56.08 6.53 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.28 -45.25 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.41 0.444 . . . . 0.0 111.921 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.4 p -55.24 -34.28 63.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.646 ' HD3' ' O ' ' A' ' 71' ' ' SER . 3.1 mpt_? -66.5 -56.45 15.32 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.86 -173.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.681 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 25.8 Cg_endo -65.61 -30.13 51.58 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.624 1.549 . . . . 0.0 112.977 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.2 mmt -67.79 -14.13 62.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.16 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -78.35 -15.27 58.88 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.451 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.569 HG23 ' HG3' ' A' ' 81' ' ' MET . 4.0 m -144.23 -169.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.933 0.397 . . . . 0.0 111.386 -174.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.725 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 58.1 t60 -89.57 99.44 12.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.681 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 38.9 mtp -136.34 169.67 12.89 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -170.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.562 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.1 Cg_endo -42.44 -0.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.935 1 C-N-CA 127.809 5.672 . . . . 0.0 118.128 177.624 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.646 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.82 -35.07 0.08 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -159.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.65 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -65.72 -51.65 57.58 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 118.664 0.665 . . . . 0.0 110.513 177.014 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.637 ' H ' ' HG2' ' A' ' 84' ' ' MET . 42.7 mtmt -67.21 -19.49 65.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.711 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.646 HD12 ' HA ' ' A' ' 83' ' ' ALA . 27.9 mt -63.86 -28.97 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.912 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.598 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 49.3 t -68.84 -35.07 76.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.717 176.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.872 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 67.7 mm-40 -68.21 -28.54 67.34 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.792 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.498 ' CD ' ' HA ' ' A' ' 86' ' ' ILE . 31.7 mttm -74.72 -40.14 61.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.24 177.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 92.3 mt -68.35 -25.21 64.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.183 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.872 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 58.2 mtpt -61.24 -21.24 63.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.526 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -76.18 -22.16 55.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.099 0.476 . . . . 0.0 110.386 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.2 -53.23 4.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.43 ' OD1' HG13 ' A' ' 97' ' ' ILE . 10.8 t70 -138.18 115.01 10.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.423 177.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.1 m -82.62 -15.01 53.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.792 0.33 . . . . 0.0 111.336 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.426 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 2.1 mp0 -65.74 -34.86 79.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.919 -177.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.543 HG12 ' HB3' ' A' ' 58' ' ' TYR . 78.3 mt -48.04 -42.0 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.47 176.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.623 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 35.9 t -72.68 -42.27 64.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.885 -173.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -81.31 14.5 2.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.67 116.03 21.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 170.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HD3' ' HB3' ' A' ' 12' ' ' GLU . 32.4 mmtp -116.58 149.65 39.31 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.811 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 98.9 m-85 -71.89 -171.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.703 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 10.9 mm-40 -56.92 -54.57 45.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 171.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 159.68 -14.06 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 O-C-N 124.785 1.303 . . . . 0.0 110.07 168.418 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.253 1.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.103 177.831 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.976 ' HB2' ' HB3' ' A' ' 23' ' ' LYS . 5.8 mm100 . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.423 ' OE2' ' HD2' ' A' ' 6' ' ' ARG . 8.0 tp10 51.25 86.05 0.04 OUTLIER 'General case' 0 C--N 1.342 0.266 0 CA-C-O 121.276 0.56 . . . . 0.0 110.11 -169.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.599 ' HB3' ' HG3' ' A' ' 7' ' ' PRO . . . -76.11 9.18 2.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.354 -174.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 102.86 -46.06 1.27 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.936 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -90.91 17.61 54.46 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.725 -178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.423 ' HD2' ' OE2' ' A' ' 2' ' ' GLU . 12.4 mmm180 55.49 75.36 0.6 Allowed Pre-proline 0 N--CA 1.466 0.349 0 C-N-CA 123.023 0.529 . . . . 0.0 110.899 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.599 ' HG3' ' HB3' ' A' ' 3' ' ' ALA . 70.4 Cg_endo -96.93 61.0 0.11 Allowed 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 123.029 2.486 . . . . 0.0 111.605 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.674 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -96.71 -19.73 26.3 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.439 -176.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.779 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . 173.21 -153.08 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.208 0.603 . . . . 0.0 109.725 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -121.39 -36.67 3.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.641 0.258 . . . . 0.0 110.354 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 42.3 m -56.36 -81.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.869 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 15' ' ' LYS . 7.3 tp10 170.41 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.727 0.299 . . . . 0.0 111.627 172.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.667 HG12 HD22 ' A' ' 55' ' ' LEU . 53.5 t -64.59 -38.16 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.477 -172.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 21.7 p -60.24 -30.71 69.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 174.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -72.18 -41.65 66.75 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.219 -175.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' HH11 ' A' ' 20' ' ' ARG . 43.6 mm-40 -56.23 -48.47 76.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.667 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -61.55 -54.98 35.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.144 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 96.0 mt -59.57 -48.16 82.76 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.502 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.7 t-20 -68.5 -44.75 74.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.466 HH11 ' HB3' ' A' ' 16' ' ' GLU . 30.7 mtp180 -64.63 -39.19 93.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.687 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 76.2 t80 -62.69 -50.24 71.92 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.954 0.883 . . . . 0.0 109.684 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.781 ' HD1' ' HG3' ' A' ' 1' ' ' GLN . 29.9 t80 -47.37 -55.06 9.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.84 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.976 ' HB3' ' HB2' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -68.74 -37.74 79.64 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.204 -179.303 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.627 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 27.2 t -59.23 -33.18 70.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.388 0.613 . . . . 0.0 110.758 -175.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.587 ' HA ' HG13 ' A' ' 30' ' ' VAL . 2.9 mp -83.04 -46.69 12.54 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.573 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 28.8 mm -67.34 -37.78 79.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.176 0.513 . . . . 0.0 110.225 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -72.28 -46.07 57.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.407 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.964 ' HG2' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -82.08 -14.15 56.24 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.031 0.443 . . . . 0.0 110.75 -177.028 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.58 1.78 60.28 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.061 172.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.964 HG12 ' HG2' ' A' ' 28' ' ' ARG . 1.9 p -87.94 99.02 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.568 ' HA ' HD11 ' A' ' 37' ' ' ILE . 7.5 t-20 -165.73 -176.96 4.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.969 -0.457 . . . . 0.0 111.253 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 62.5 38.57 12.51 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.35 0.66 . . . . 0.0 111.54 -177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.599 ' O ' HG12 ' A' ' 37' ' ' ILE . 55.5 m -157.8 104.94 1.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.913 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.4 mm? -58.95 -43.68 91.29 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -172.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.46 -38.25 83.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.25 0.548 . . . . 0.0 110.715 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.409 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 48.1 m -73.6 -40.82 63.55 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.333 -178.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 33' ' ' SER . 35.9 mm -58.58 -37.61 65.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -69.46 -44.26 71.58 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 32.3 mmtm -77.0 -18.8 57.96 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.925 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.592 ' HG3' HG21 ' A' ' 30' ' ' VAL . 62.1 mm-40 -85.35 -28.02 25.48 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.933 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HD21 ' A' ' 70' ' ' LEU . 13.2 mt -59.71 -55.46 34.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 168.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.44 HD12 ' HD3' ' A' ' 39' ' ' LYS . 60.4 mt -53.63 -43.85 55.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.069 176.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -63.85 -48.1 78.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.905 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -68.55 -32.92 73.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.854 0.359 . . . . 0.0 110.595 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 91.3 m -66.07 -22.62 66.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.946 0.403 . . . . 0.0 110.872 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.8 tp -87.64 -41.57 13.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.104 172.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -79.17 48.35 0.86 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.731 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -142.05 -172.65 3.62 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.521 177.773 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -97.56 173.46 7.14 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.58 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.51 -43.25 58.59 Favored Glycine 0 C--N 1.33 0.224 0 O-C-N 123.548 0.53 . . . . 0.0 114.022 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.7 tppt? -61.14 -42.25 98.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.135 0.493 . . . . 0.0 110.153 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 20.6 mt-10 -78.27 -37.56 44.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.766 -176.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -57.54 -40.57 79.12 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -78.96 -36.38 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.633 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.667 HD22 HG12 ' A' ' 13' ' ' VAL . 38.3 tp -53.63 -34.62 59.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.569 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 9.2 t -68.12 -15.35 63.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -74.56 -21.09 59.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.292 0.568 . . . . 0.0 109.964 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.551 ' HB3' HG12 ' A' ' 97' ' ' ILE . 98.7 m-85 -86.12 -34.56 20.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.008 174.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.78 -36.11 67.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.503 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.56 -3.76 34.6 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 121.057 -0.592 . . . . 0.0 113.862 172.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 70' ' ' LEU . . . -92.44 53.22 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -173.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -126.07 -84.94 0.62 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.058 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 62' ' ' THR . 27.5 mtpp -146.09 -70.21 0.26 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.138 0.494 . . . . 0.0 110.067 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -126.59 101.62 6.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.958 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -161.18 -79.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.753 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -148.41 60.99 1.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.308 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -68.65 -19.22 64.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.536 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -81.51 -27.28 34.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.026 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.517 ' HB ' HD23 ' A' ' 93' ' ' LEU . 6.7 pt -86.11 -18.93 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-O 121.368 0.604 . . . . 0.0 109.547 175.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 61' ' ' ALA . 2.7 tm? -65.72 -26.85 67.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.712 -173.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.668 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 2.6 m -60.32 -27.85 67.67 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.322 0.582 . . . . 0.0 110.698 178.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.65 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 8.8 tp10 -72.2 -14.69 61.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.406 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.574 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 58.1 t -87.91 -53.22 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.008 0.432 . . . . 0.0 110.484 172.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -55.48 -53.08 60.78 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -172.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.668 ' HD3' ' O ' ' A' ' 71' ' ' SER . 1.5 mtp-105 -58.48 -51.73 79.72 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.686 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.731 ' HB3' ' SD ' ' A' ' 81' ' ' MET . 47.9 Cg_exo -61.52 -39.43 55.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.565 1.51 . . . . 0.0 113.361 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.492 ' HG3' ' HE2' ' A' ' 21' ' ' PHE . 23.8 mmt -61.81 -16.68 51.91 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.882 0.372 . . . . 0.0 111.281 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.567 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 40.6 t -75.31 -11.76 60.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.572 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -136.95 168.67 21.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -71.02 96.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.822 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -118.12 158.78 45.41 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.854 -163.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.822 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 25.0 Cg_exo -40.55 3.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.745 1 C-N-CA 127.831 5.687 . . . . 0.0 118.034 167.618 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.91 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -163.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.674 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -64.51 -48.56 74.7 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.955 1.252 . . . . 0.0 109.583 173.116 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 34.8 ttmt -66.29 -20.7 66.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.198 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 83' ' ' ALA . 44.8 mt -66.22 -30.85 51.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.059 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 90' ' ' LEU . 50.0 t -78.46 -20.34 51.15 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.887 176.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.592 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 4.8 tp10 -64.34 -50.75 66.55 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 46.8 mtmt -63.17 -33.25 75.06 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.515 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 13.3 mt -61.87 -21.86 65.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.677 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.647 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 26.7 mtmm -64.61 -24.03 67.46 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.964 -176.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 92' ' ' LYS . 24.6 tptp -79.78 -19.09 49.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.205 0.526 . . . . 0.0 110.254 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.8 mp -85.87 -48.16 9.0 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -160.44 122.61 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.992 174.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -84.37 -14.01 50.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.007 0.432 . . . . 0.0 110.959 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -75.28 -14.29 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.551 HG12 ' HB3' ' A' ' 58' ' ' TYR . 83.3 mt -60.61 -33.05 53.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 122.001 0.905 . . . . 0.0 109.181 170.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.647 ' SG ' ' HG2' ' A' ' 91' ' ' LYS . 90.9 m -87.67 -51.4 5.9 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.597 -177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.09 43.94 1.04 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.195 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.556 ' O ' HG21 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -111.53 48.76 0.93 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -62.01 158.04 17.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.395 -172.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.464 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 71.2 m-85 -70.73 87.05 0.68 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.952 -178.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 68.57 90.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.003 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -94.69 110.68 22.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.29 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.5 p . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.652 -179.731 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.465 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER 71.59 149.97 0.09 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.33 0.586 . . . . 0.0 111.62 176.749 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.92 5.31 2.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.522 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 121.72 67.25 0.25 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.694 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.01 32.73 38.8 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.647 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? 52.58 65.85 5.6 Favored Pre-proline 0 N--CA 1.465 0.309 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -83.56 47.27 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.437 2.091 . . . . 0.0 111.01 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.958 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -66.77 -41.2 93.79 Favored Glycine 0 N--CA 1.439 -1.132 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.525 -169.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.615 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -179.51 -82.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.545 0.688 . . . . 0.0 110.953 -173.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -165.21 -70.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.635 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 p -68.33 128.92 38.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.429 175.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.673 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 34.2 mp0 -48.26 -76.92 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.84 HG12 HD22 ' A' ' 55' ' ' LEU . 59.3 t -51.73 -42.47 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.3 t -63.87 -46.23 85.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.073 0.463 . . . . 0.0 110.27 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.1 ptmt -68.96 -36.52 78.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.435 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.1 mm-40 -61.84 -51.38 68.47 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.096 -178.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -65.01 -54.51 29.29 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.334 -176.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.568 HD12 ' SG ' ' A' ' 87' ' ' CYS . 71.3 mt -58.08 -52.95 63.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -174.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.958 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -68.54 -36.2 78.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.937 0.399 . . . . 0.0 111.309 -175.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.2 ttm180 -73.68 -39.12 64.63 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.33 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.535 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 87.3 t80 -61.84 -49.37 76.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.589 0.709 . . . . 0.0 109.241 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.455 ' O ' HG12 ' A' ' 26' ' ' ILE . 40.8 t80 -48.86 -47.89 42.41 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.05 178.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 2' ' ' GLU . 4.7 mmtp -77.57 -46.93 20.75 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.6 t -57.7 -29.03 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.092 0.473 . . . . 0.0 110.683 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 3.9 tp -72.03 -41.61 67.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.446 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 22' ' ' TYR . 40.7 mm -68.66 -36.67 75.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.488 0.661 . . . . 0.0 109.637 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.39 -45.67 86.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.387 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 28' ' ' ARG . 18.1 mtp180 -70.19 -26.1 63.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.404 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.95 12.44 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.564 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.672 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.41 126.7 71.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 114.749 -0.725 . . . . 0.0 109.339 -178.464 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' O ' HD11 ' A' ' 37' ' ' ILE . 63.3 t30 -173.91 -45.18 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 175.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -79.54 47.36 0.82 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.335 0.588 . . . . 0.0 111.784 -173.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 37' ' ' ILE . 20.4 m -157.88 109.56 2.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.825 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.9 mm? -57.88 -41.64 82.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.977 -176.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -59.09 -41.95 89.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.232 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -70.72 -42.65 70.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.514 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.537 HD11 ' O ' ' A' ' 31' ' ' ASN . 67.3 mt -57.69 -37.39 59.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -71.16 -47.24 58.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.086 -178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.676 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -60.97 -43.38 98.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.482 ' HG3' HG21 ' A' ' 30' ' ' VAL . 4.8 mm-40 -78.55 -27.04 45.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -176.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.535 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 6.2 mt -59.28 -48.83 80.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.51 -47.27 85.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.67 175.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.5 m -60.05 -47.28 86.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.299 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -71.09 -38.51 72.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.48 -175.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.452 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 54.5 m -66.62 -28.65 68.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -86.02 -20.14 29.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.093 0.473 . . . . 0.0 110.641 176.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -87.47 -24.64 24.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.314 -175.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -70.13 -173.76 0.72 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.846 -179.445 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -96.34 174.36 6.91 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.284 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.01 -47.86 39.68 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 114.758 0.663 . . . . 0.0 114.758 -169.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' HE2' ' H ' ' A' ' 103' ' ' GLU . 13.5 mptt -61.2 -36.35 79.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.258 0.529 . . . . 0.0 111.371 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.0 mt-10 -80.67 -38.75 28.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.094 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.6 m-20 -58.1 -47.32 83.61 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -64.35 -38.5 91.25 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.735 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.84 HD22 HG12 ' A' ' 13' ' ' VAL . 34.1 tp -57.88 -36.87 72.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.5 m -70.92 -17.39 62.69 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.72 -29.7 67.16 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -86.17 -38.61 17.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.36 177.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.1 mt -73.22 -25.88 60.91 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.571 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.618 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.12 -9.52 42.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.487 174.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -81.78 55.85 2.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.724 0.773 . . . . 0.0 111.118 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 64' ' ' ASP . 24.8 m -156.82 140.71 16.19 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -75.68 19.72 0.19 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.039 0.447 . . . . 0.0 112.023 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 62' ' ' THR . 1.2 m-20 -127.16 1.93 6.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.886 176.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.92 -174.16 2.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.775 -172.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.421 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -67.66 136.51 54.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.961 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 p -84.41 -35.52 23.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.854 -175.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -72.88 -22.49 60.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.07 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.618 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.1 tt -85.67 -24.92 6.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.256 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.614 HD13 ' HA ' ' A' ' 61' ' ' ALA . 21.2 tp -61.5 -43.55 98.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.439 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 16.0 p -68.57 -23.01 64.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -75.89 -19.94 58.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.652 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.44 ' O ' ' HG2' ' A' ' 77' ' ' MET . 48.3 t -88.73 -52.09 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.282 172.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.511 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 18.4 p -55.27 -49.45 72.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.604 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.0 mpt_? -55.46 -54.59 49.41 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -176.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.459 ' HB3' ' HE2' ' A' ' 81' ' ' MET . 27.7 Cg_endo -66.49 -13.27 39.22 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.898 1.732 . . . . 0.0 114.41 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 24.4 mmt -77.25 -25.38 51.47 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.087 176.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 t -73.63 -13.97 61.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.202 -175.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.37 163.53 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.42 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 75.2 t60 -70.14 89.28 0.63 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.36 0.527 . . . . 0.0 110.201 178.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.496 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 5.3 mtp -110.29 176.86 1.37 Allowed Pre-proline 0 C--N 1.318 -0.767 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.337 -176.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.545 ' O ' HG13 ' A' ' 86' ' ' ILE . 33.1 Cg_exo -42.69 -0.17 0.01 OUTLIER 'Trans proline' 0 C--O 1.212 -0.801 1 C-N-CA 126.113 4.542 . . . . 0.0 116.904 171.162 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.748 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.55 -41.07 0.64 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.133 1.333 . . . . 0.0 114.052 -169.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.696 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -61.98 -56.87 14.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.043 0.925 . . . . 0.0 109.543 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 39.3 ttmt -62.07 -14.53 37.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.232 178.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 83' ' ' ALA . 42.0 mt -70.51 -26.01 27.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 O-C-N 122.037 -0.414 . . . . 0.0 111.3 -177.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.568 ' SG ' HD12 ' A' ' 18' ' ' LEU . 84.8 m -73.05 -17.48 61.42 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.816 0.817 . . . . 0.0 110.213 173.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.9 mt-10 -85.94 -45.34 11.59 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.187 171.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 86' ' ' ILE . 26.4 ttpp -64.06 -38.18 90.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.384 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.19 -14.48 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -66.82 -14.92 63.21 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.953 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -67.36 -29.13 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.463 0.649 . . . . 0.0 109.56 173.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.6 mp -94.23 -47.41 6.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.109 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.411 ' OD2' HG13 ' A' ' 97' ' ' ILE . 23.4 t70 -161.27 124.15 3.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.022 -179.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.4 p -86.82 -16.16 37.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.739 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.666 ' HA ' ' HG2' ' A' ' 99' ' ' GLU . 1.9 mp0 -72.15 -19.67 61.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.717 0.294 . . . . 0.0 111.346 -175.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.411 HG13 ' OD2' ' A' ' 94' ' ' ASP . 71.3 mt -54.66 -30.8 22.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.332 0.587 . . . . 0.0 110.585 174.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 13.3 m -82.45 -24.76 34.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.592 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.666 ' HG2' ' HA ' ' A' ' 96' ' ' GLN . 11.8 pt-20 -100.6 20.65 14.69 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.45 -63.6 1.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' A' ' 104' ' ' LYS . 69.5 mmtt 66.19 131.7 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.748 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -67.12 101.03 0.83 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.407 ' H ' ' HE2' ' A' ' 51' ' ' LYS . 31.1 mm-40 65.03 33.59 9.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.699 -173.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.607 ' HA ' ' HB2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER 60.12 45.23 12.03 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.365 175.518 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.922 173.143 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.443 ' HB2' ' H ' ' A' ' 2' ' ' GLU . 3.9 mm100 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.443 ' H ' ' HB2' ' A' ' 1' ' ' GLN . 6.4 mm-40 69.86 168.67 0.3 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 169.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.469 ' HB2' ' HG2' ' A' ' 23' ' ' LYS . . . -171.25 10.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 113.877 -1.51 . . . . 0.0 109.902 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.3 49.82 0.22 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.646 -0.788 . . . . 0.0 113.278 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 118.18 10.52 8.84 Favored Glycine 0 CA--C 1.516 0.142 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.923 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.64 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 5.5 tpt180 54.85 43.27 1.3 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 123.037 0.535 . . . . 0.0 112.327 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.64 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 64.6 Cg_endo -103.42 78.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.961 2.44 . . . . 0.0 112.472 -173.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.771 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -88.09 -23.17 38.89 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.883 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.534 ' N ' ' HG2' ' A' ' 15' ' ' LYS . . . 172.92 -129.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.33 -0.935 . . . . 0.0 108.487 -175.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -139.3 -33.38 0.62 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 169.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.618 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 26.5 m -60.38 106.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.976 167.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -48.88 -69.52 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -165.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.546 HG11 ' HB2' ' A' ' 100' ' ' LEU . 14.3 p -59.46 -31.37 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.613 0.721 . . . . 0.0 110.52 -174.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 11' ' ' CYS . 51.2 t -69.88 -35.81 74.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.371 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 11' ' ' CYS . 55.9 mtpt -57.04 -53.79 54.05 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.266 0.555 . . . . 0.0 109.915 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.534 ' HB3' HH11 ' A' ' 20' ' ' ARG . 13.5 mm-40 -53.7 -51.78 62.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.318 -177.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.663 ' HE2' ' HA ' ' A' ' 45' ' ' CYS . 43.6 t80 -61.4 -55.44 31.38 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.86 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.95 -49.41 77.55 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -174.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.771 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 25.5 t-20 -68.56 -46.8 68.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.354 -174.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.534 HH11 ' HB3' ' A' ' 16' ' ' GLU . 46.2 mtp180 -63.18 -41.27 99.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.114 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.03 -48.67 80.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.622 0.725 . . . . 0.0 109.827 175.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.664 ' HE2' ' H ' ' A' ' 81' ' ' MET . 47.9 t80 -51.91 -55.85 17.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.201 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -73.51 -30.23 62.99 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.329 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.602 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 71.9 m -64.62 -45.85 85.13 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 121.205 -0.198 . . . . 0.0 110.47 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.2 mp -63.46 -41.41 98.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.588 0.233 . . . . 0.0 111.36 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.533 HG12 ' O ' ' A' ' 22' ' ' TYR . 39.7 mm -67.23 -40.03 84.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.057 0.456 . . . . 0.0 110.278 177.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.57 -44.94 73.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.148 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 28' ' ' ARG . 10.2 mtp180 -72.04 -15.26 62.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.1 39.43 27.39 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.628 HG21 ' HG3' ' A' ' 40' ' ' GLU . 0.7 OUTLIER -130.92 98.76 3.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.204 0.526 . . . . 0.0 110.123 -177.474 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -168.49 -177.83 3.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.057 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 57.3 31.98 21.01 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.289 0.566 . . . . 0.0 111.515 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.588 ' O ' HG12 ' A' ' 37' ' ' ILE . 62.8 m -150.75 107.56 3.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 176.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.706 HD13 ' HE ' ' A' ' 75' ' ' ARG . 95.1 mt -60.09 -41.64 92.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.391 -170.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -67.59 -28.94 68.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.257 0.551 . . . . 0.0 109.874 -178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 m -78.14 -37.5 45.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.859 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 33' ' ' SER . 17.0 mm -64.6 -32.54 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.476 ' CG ' HG21 ' A' ' 74' ' ' THR . 41.1 mt-10 -66.01 -23.68 66.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.694 178.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -85.77 -52.48 5.74 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.147 0.498 . . . . 0.0 110.382 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.628 ' HG3' HG21 ' A' ' 30' ' ' VAL . 7.1 mm-40 -71.64 -25.9 62.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.46 -171.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 7.3 mt -58.45 -38.38 77.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 171.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.1 mt -74.71 -45.96 43.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.144 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 m -57.58 -45.21 85.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.177 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -78.3 -32.93 49.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.954 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.663 ' HA ' ' HE2' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -73.06 -19.41 61.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.342 0.591 . . . . 0.0 110.14 -179.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.0 tp -86.35 -41.23 14.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.044 170.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.73 63.61 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.661 0.743 . . . . 0.0 110.492 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.742 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -158.71 -172.42 3.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.595 -179.146 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -98.71 171.49 8.07 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.061 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.69 -43.88 38.12 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 123.644 0.59 . . . . 0.0 114.573 -171.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 7.7 tptp -63.09 -35.36 80.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.312 0.577 . . . . 0.0 110.681 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.742 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 16.0 mt-10 -85.48 -36.43 20.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.242 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.578 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 81.6 m-20 -61.39 -39.06 89.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.552 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 19.7 tpt180 -75.08 -35.72 61.79 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.1 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD13 HD12 ' A' ' 100' ' ' LEU . 49.6 tp -58.66 -25.18 62.51 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.333 0.587 . . . . 0.0 110.361 175.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 53' ' ' ASN . 13.2 t -62.29 -32.38 73.09 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.391 176.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -74.91 -17.92 60.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 0.0 109.807 177.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.68 ' HB3' HG12 ' A' ' 97' ' ' ILE . 84.8 m-85 -86.08 -55.13 4.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.904 176.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.8 -18.36 65.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.642 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 82.64 36.13 17.37 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.416 175.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.404 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -93.63 16.87 12.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.215 0.531 . . . . 0.0 110.587 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.489 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -132.91 128.58 36.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.468 178.097 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 67' ' ' THR . 54.9 mtpt -76.91 -10.3 59.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.182 0.515 . . . . 0.0 110.262 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -74.86 -14.82 60.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.039 174.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.29 -139.65 0.32 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.872 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.63 102.04 0.06 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.158 0.504 . . . . 0.0 109.93 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.469 HG23 ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -86.39 -37.84 17.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.149 -169.298 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -72.28 -35.96 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.511 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.642 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.3 tt -64.12 -23.85 34.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.266 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.97 -49.95 70.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.462 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 8.0 m -66.48 -27.19 67.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.753 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -75.29 -21.51 58.44 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.064 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.537 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.0 t -87.21 -41.91 14.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.943 173.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.476 HG21 ' CG ' ' A' ' 38' ' ' GLU . 39.7 p -60.68 -42.03 96.3 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.706 ' HE ' HD13 ' A' ' 34' ' ' LEU . 4.3 mpt_? -55.69 -53.47 62.36 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.517 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.537 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 31.8 Cg_exo -62.52 -45.78 13.56 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.865 1.71 . . . . 0.0 112.828 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 14.3 mmt -62.78 -14.81 49.5 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB2' HD23 ' A' ' 34' ' ' LEU . 40.4 t -66.79 -14.45 62.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.423 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.02 162.26 34.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -61.63 107.1 0.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 175.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.843 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -119.68 153.42 54.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -163.166 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.843 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 24.9 Cg_exo -40.56 3.48 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.952 1 C-N-CA 127.923 5.749 . . . . 0.0 117.919 167.183 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.729 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.59 -31.7 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 115.618 1.71 . . . . 0.0 115.618 -164.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.496 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -50.93 -49.32 60.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.462 0.648 . . . . 0.0 110.257 173.158 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 18.0 ptpt -85.81 -15.16 42.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.474 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.808 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 15.2 mt -59.39 -42.67 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HD12 ' A' ' 90' ' ' LEU . 19.4 t -67.32 -22.07 65.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.286 0.565 . . . . 0.0 111.102 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 15.5 tp10 -76.41 -44.16 37.25 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.808 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 10.1 mtmp? -61.11 -24.96 66.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.17 176.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 87' ' ' CYS . 23.1 mt -66.75 -17.82 65.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.264 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -63.53 -20.62 65.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.782 0.325 . . . . 0.0 110.806 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -69.04 -29.51 67.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.181 0.515 . . . . 0.0 110.333 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.56 -59.49 2.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.321 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -151.33 134.2 15.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.345 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.9 m -85.24 -19.55 31.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.465 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -68.07 -30.87 70.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.894 0.378 . . . . 0.0 110.668 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.68 HG12 ' HB3' ' A' ' 58' ' ' TYR . 20.2 mt -56.55 -33.55 39.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.234 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.609 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 53.7 t -75.04 -35.98 61.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.748 -174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -85.99 -107.92 0.05 Allowed 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.298 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 55' ' ' LEU . 73.7 mt 64.39 -69.45 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.888 0.475 . . . . 0.0 111.059 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 70.2 149.25 0.08 Allowed 'General case' 0 C--O 1.231 0.119 0 O-C-N 123.931 0.769 . . . . 0.0 110.836 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -73.06 -47.4 44.99 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.357 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -130.28 -17.84 3.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.101 -178.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 63.53 39.05 9.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.653 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.661 178.649 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 N--CA 1.478 0.938 0 CA-C-O 121.513 0.673 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.743 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 7.9 mp0 -141.42 -168.4 2.63 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -175.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.6 ' HA ' ' HB2' ' A' ' 6' ' ' ARG . . . -116.85 -87.33 0.61 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 166.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.83 -99.72 0.1 OUTLIER Glycine 0 CA--C 1.517 0.184 0 C-N-CA 121.149 -0.548 . . . . 0.0 112.607 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.43 -27.62 73.68 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 174.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.6 ' HB2' ' HA ' ' A' ' 3' ' ' ALA . 30.7 mtm180 -73.18 141.74 81.37 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 10.1 Cg_endo -90.1 86.99 0.37 Allowed 'Trans proline' 0 N--CA 1.444 -1.436 0 C-N-CA 123.175 2.584 . . . . 0.0 111.226 -171.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.599 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -76.14 -29.94 57.91 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 119.065 -1.541 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.467 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.43 -94.08 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.481 -0.86 . . . . 0.0 109.201 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.444 ' HB3' ' CD ' ' A' ' 88' ' ' GLU . 19.3 t70 -164.25 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 170.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 92.5 m -59.8 166.72 2.47 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.402 166.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 40.2 tt0 -89.77 -77.73 0.38 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -167.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.852 HG12 HD22 ' A' ' 55' ' ' LEU . 59.6 t -55.04 -42.57 65.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.289 0.566 . . . . 0.0 111.322 -170.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.673 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.8 t -63.51 -36.0 82.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.73 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 16' ' ' GLU . 2.5 ptpp? -69.25 -35.61 76.29 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.68 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.528 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 61.7 mm-40 -56.88 -55.15 38.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.628 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -57.42 -55.04 39.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.821 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.577 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.0 mt -61.5 -38.84 88.78 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.048 -173.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -64.45 -55.36 21.39 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.17 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.743 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 0.9 OUTLIER -53.57 -55.56 24.6 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 176.132 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.24 -50.71 61.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.529 0.68 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.586 ' O ' HG12 ' A' ' 26' ' ' ILE . 54.9 t80 -53.79 -55.27 27.95 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 113.998 -1.456 . . . . 0.0 111.257 -178.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.95 -34.02 59.84 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.527 -176.233 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 75.2 m -58.29 -46.26 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.664 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.605 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 2.4 mp -66.33 -44.91 81.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.072 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 22' ' ' TYR . 48.6 mm -59.88 -38.69 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.608 177.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -64.1 -39.38 93.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.864 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB3' HG23 ' A' ' 30' ' ' VAL . 32.6 mtm180 -83.23 -14.85 52.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.115 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.0 15.35 62.99 Favored Glycine 0 N--CA 1.453 -0.177 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.605 ' HB ' ' HG ' ' A' ' 25' ' ' LEU . 43.7 t -93.74 106.0 17.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 114.245 -0.978 . . . . 0.0 110.043 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.758 ' HA ' HD11 ' A' ' 37' ' ' ILE . 1.0 OUTLIER -164.43 -55.26 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 118.499 -1.28 . . . . 0.0 114.212 176.576 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -78.74 59.04 2.43 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.637 0.732 . . . . 0.0 110.575 -174.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.8 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 13.5 m -157.95 101.65 1.79 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.063 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.45 -46.74 76.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.807 -176.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.93 -30.68 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.279 0.561 . . . . 0.0 110.47 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.8 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 51.6 m -76.02 -46.33 29.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.498 -177.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.758 HD11 ' HA ' ' A' ' 31' ' ' ASN . 32.3 mm -58.52 -33.8 49.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -63.27 -50.71 69.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.884 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -65.21 -39.0 92.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.357 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.509 ' HG3' HG11 ' A' ' 30' ' ' VAL . 53.6 mm-40 -70.19 -40.64 74.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.299 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.566 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 16.8 mt -55.5 -55.54 30.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 59.2 mt -54.76 -47.43 74.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.429 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.4 m -63.93 -51.27 65.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.503 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -67.05 -35.37 79.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.052 0.453 . . . . 0.0 110.353 -176.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.97 -33.63 75.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.243 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.1 mm? -87.63 -20.73 25.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.904 0.383 . . . . 0.0 111.419 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.68 -31.57 61.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.062 0.458 . . . . 0.0 111.262 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.769 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -69.66 -170.42 0.3 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.876 -178.255 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -95.82 171.18 8.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.113 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -42.68 43.63 Favored Glycine 0 N--CA 1.453 -0.205 0 O-C-N 123.687 0.617 . . . . 0.0 114.408 -169.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 14.8 tptt -61.81 -39.27 91.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.519 0.676 . . . . 0.0 110.317 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.769 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.0 mt-10 -80.81 -35.99 32.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.36 -175.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -63.42 -43.41 97.58 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.573 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 12.6 tpt180 -63.12 -37.38 86.97 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.661 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.852 HD22 HG12 ' A' ' 13' ' ' VAL . 61.6 tp -56.18 -45.09 79.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.633 176.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 57.3 m -71.01 -14.52 62.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.067 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 9.9 m-85 -65.45 -32.21 73.71 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 172.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.544 ' HB3' HG12 ' A' ' 97' ' ' ILE . 91.1 m-85 -85.74 -39.11 17.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.267 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 95.8 mt -66.84 -19.84 65.81 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.891 177.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.558 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 86.79 12.12 69.46 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.023 174.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -98.55 19.12 15.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.064 0.459 . . . . 0.0 111.894 -174.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.1 p -102.06 160.51 14.45 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -75.74 -4.7 41.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -168.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -124.4 19.55 8.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.12 0.486 . . . . 0.0 110.318 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.74 -178.3 3.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.775 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.69 119.39 18.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.59 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.5 p -74.06 -17.3 60.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.771 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -58.46 -50.5 73.51 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.558 HG23 ' HA3' ' A' ' 60' ' ' GLY . 12.9 tt -75.44 -31.08 23.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.184 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.0 tt -56.3 -55.16 36.82 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.469 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 8.1 p -67.03 -29.62 69.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.072 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.48 -22.74 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.03 0.443 . . . . 0.0 110.41 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.675 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 98.1 t -85.81 -48.81 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.484 175.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 37' ' ' ILE . 41.3 p -61.01 -36.91 80.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 71' ' ' SER . 2.1 mpp_? -54.47 -56.07 30.73 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.546 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.675 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 11.8 Cg_exo -71.67 -36.72 6.1 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.579 1.52 . . . . 0.0 112.436 174.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.449 ' HB2' ' HA ' ' A' ' 74' ' ' THR . 3.8 mmt -59.46 -20.52 55.77 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -60.8 -13.64 16.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.3 m -126.45 174.74 9.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -64.89 88.21 0.06 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.807 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 14.1 tpt -103.28 149.58 37.1 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -162.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.807 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 23.4 Cg_exo -41.41 3.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 127.771 5.647 . . . . 0.0 117.978 168.355 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.523 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.44 -27.52 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -165.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.599 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -53.12 -49.0 67.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.808 0.813 . . . . 0.0 109.476 171.615 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE3' ' HB3' ' A' ' 82' ' ' PRO . 41.1 mtmt -74.01 -30.41 62.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.315 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.551 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 39.6 mt -60.53 -41.44 87.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.942 -174.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.577 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 43.9 t -63.07 -33.0 74.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.318 0.58 . . . . 0.0 110.93 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.444 ' CD ' ' HB3' ' A' ' 10' ' ' ASP . 69.6 mm-40 -74.81 -36.07 62.47 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.119 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.18 -28.24 66.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.015 175.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.449 ' HA ' HD13 ' A' ' 93' ' ' LEU . 28.8 mt -71.04 -15.77 62.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.302 177.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -69.8 -16.12 63.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 0.0 110.334 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -68.92 -24.95 64.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.6 176.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 90' ' ' LEU . 7.0 mp -80.91 -53.53 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.719 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HB3' HG13 ' A' ' 97' ' ' ILE . 24.2 t70 -164.66 143.16 6.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.846 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.2 p -79.34 -22.75 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -173.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -73.12 -20.29 60.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.544 HG12 ' HB3' ' A' ' 58' ' ' TYR . 10.1 mt -62.97 -33.1 58.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.177 -178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 14' ' ' CYS . 12.4 p -104.63 -28.45 11.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.855 0.36 . . . . 0.0 110.935 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -76.12 -94.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.169 -171.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 25.3 mt 65.71 -63.56 0.21 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.807 0.692 . . . . 0.0 111.948 -177.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 71.01 123.59 0.03 OUTLIER 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.658 0.783 . . . . 0.0 111.192 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -63.2 154.79 30.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.775 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.9 95.45 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.777 0.673 . . . . 0.0 111.577 -172.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.732 ' HD3' ' H ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -93.1 0.58 57.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.954 179.808 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.25 1.083 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.036 178.437 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.669 ' HG2' ' HE2' ' A' ' 22' ' ' TYR . 19.3 mt-30 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.476 ' HG3' ' HG2' ' A' ' 23' ' ' LYS . 42.2 mt-10 68.56 -50.22 0.57 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.889 0.876 . . . . 0.0 112.246 -173.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.81 148.07 46.61 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.607 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 114.13 36.3 1.37 Allowed Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 -176.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.35 30.51 71.4 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.192 -0.527 . . . . 0.0 112.015 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 18.2 mmm180 56.87 68.46 2.11 Favored Pre-proline 0 N--CA 1.462 0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.318 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.32 51.94 0.8 Allowed 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 123.01 2.473 . . . . 0.0 111.512 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.765 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -65.73 -34.11 87.89 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.456 -0.878 . . . . 0.0 110.931 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -176.01 -136.64 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.228 -0.986 . . . . 0.0 108.638 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -121.8 -52.62 2.0 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.633 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 3.1 m -54.8 95.42 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.221 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.522 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 42.0 tp10 -41.14 -58.0 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -168.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.873 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -60.49 -52.36 62.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.131 0.491 . . . . 0.0 111.191 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HA ' HD21 ' A' ' 55' ' ' LEU . 3.0 t -62.49 -35.73 80.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.495 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.563 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 3.3 ttmt -56.46 -52.74 63.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.795 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.5 ' N ' ' HG2' ' A' ' 15' ' ' LYS . 55.2 mm-40 -56.57 -48.94 76.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.628 178.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -57.37 -50.44 72.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.747 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.862 HD11 ' HB2' ' A' ' 87' ' ' CYS . 98.0 mt -58.83 -55.93 28.72 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -175.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.765 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -66.23 -39.86 89.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.684 0.278 . . . . 0.0 111.311 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 -68.05 -36.38 79.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.697 0.284 . . . . 0.0 110.557 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.94 -46.45 68.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.805 0.812 . . . . 0.0 109.427 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.669 ' HE2' ' HG2' ' A' ' 1' ' ' GLN . 86.1 t80 -48.48 -52.88 20.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.521 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.631 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -74.4 -36.38 63.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.631 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 72.2 m -63.73 -31.81 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 25' ' ' LEU . 1.1 tp -75.84 -24.01 55.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.768 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 22' ' ' TYR . 45.2 mm -84.07 -37.09 12.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -56.35 -54.9 40.07 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.249 172.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -78.23 -20.5 51.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.838 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.73 28.37 70.94 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.285 174.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.549 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.0 OUTLIER -100.1 9.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 122.402 1.096 . . . . 0.0 110.073 -176.332 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.49 ' ND2' HD23 ' A' ' 25' ' ' LEU . 2.4 t-20 -88.45 8.33 28.44 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.991 -1.459 . . . . 0.0 112.388 -164.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -108.14 8.4 28.03 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.48 -177.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.476 ' O ' HG13 ' A' ' 37' ' ' ILE . 14.8 m -124.94 118.72 26.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.002 175.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -62.03 -41.17 97.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.268 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -66.1 -29.29 69.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.583 0.706 . . . . 0.0 109.767 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.9 m -76.59 -42.75 41.43 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.522 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 33' ' ' SER . 73.0 mt -58.12 -34.96 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.448 ' O ' HG13 ' A' ' 42' ' ' ILE . 35.7 tt0 -63.86 -52.32 60.58 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.834 178.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -67.5 -36.22 80.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.071 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.549 ' HG3' HG21 ' A' ' 30' ' ' VAL . 8.5 mm-40 -67.36 -38.16 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.382 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 20.1 tp -60.28 -36.39 77.72 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 38' ' ' GLU . 85.9 mt -67.79 -50.54 59.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.714 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -59.39 -42.77 92.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.408 -179.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.35 -32.79 72.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.153 0.501 . . . . 0.0 109.837 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 2.2 t -68.29 -31.87 71.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.327 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.5 tp -85.27 -30.97 23.36 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.266 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -97.1 51.99 1.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.823 0.82 . . . . 0.0 110.551 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.7 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -141.93 -170.13 3.07 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.23 178.073 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.492 ' HD2' ' N ' ' A' ' 49' ' ' LYS . 10.8 mptt -97.16 166.12 11.73 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.536 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.32 -43.29 19.36 Favored Glycine 0 C--N 1.329 0.187 0 O-C-N 123.876 0.735 . . . . 0.0 114.471 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.427 ' HD3' ' HA ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -61.55 -36.33 80.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.103 0.477 . . . . 0.0 110.716 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.3 mt-10 -85.09 -34.76 22.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.158 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.27 -43.31 96.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 23.2 tpt180 -72.25 -35.2 68.74 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.488 177.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.873 HD22 HG12 ' A' ' 13' ' ' VAL . 57.8 tp -56.35 -39.05 72.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.384 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.697 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -71.28 -15.07 62.41 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.139 -176.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.1 m-85 -66.32 -34.23 77.51 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.163 0.506 . . . . 0.0 109.665 174.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 97' ' ' ILE . 24.1 m-85 -83.3 -23.77 32.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.712 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.507 ' CD2' HD11 ' A' ' 97' ' ' ILE . 22.5 mt -79.38 -19.33 50.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.15 173.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 65' ' ' ALA . . . 92.78 0.32 69.16 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 113.475 175.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.574 ' HB2' ' HG ' ' A' ' 41' ' ' LEU . . . -60.95 -33.73 73.64 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -172.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.697 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -74.26 -8.37 56.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.403 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm 68.69 -7.16 0.75 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.145 0.578 . . . . 0.0 111.403 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 62' ' ' THR . 19.6 t70 -72.03 -23.96 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.863 0.84 . . . . 0.0 109.245 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.608 ' HB3' ' HA2' ' A' ' 60' ' ' GLY . . . -90.94 -167.52 1.84 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.69 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.652 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -62.84 133.29 54.49 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.091 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.56 -21.3 52.72 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -77.85 -26.26 49.26 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.949 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 66' ' ' ALA . 15.0 pt -76.35 -22.87 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 120.964 0.411 . . . . 0.0 110.203 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.34 -48.68 72.16 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.71 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 18.9 m -63.16 -34.17 77.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.218 174.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HB3' ' O ' ' A' ' 69' ' ' ILE . 12.4 tp10 -53.74 -33.52 55.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.236 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.69 -53.57 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.324 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.62 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 41.8 p -58.92 -33.56 70.71 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.71 ' HG2' ' O ' ' A' ' 71' ' ' SER . 21.6 mmt180 -64.43 -57.45 17.29 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.214 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 49.3 Cg_endo -71.11 -15.62 32.07 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.857 1.704 . . . . 0.0 112.74 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.8 mmt -73.05 -19.98 61.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.419 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.43 ' HA ' HD11 ' A' ' 37' ' ' ILE . 23.5 t -61.78 -13.61 25.27 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.789 HG13 ' HG3' ' A' ' 81' ' ' MET . 13.3 p -153.48 148.26 13.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -48.07 111.83 0.49 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.041 0.448 . . . . 0.0 110.424 176.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.789 ' HG3' HG13 ' A' ' 79' ' ' VAL . 21.6 mtp -144.7 178.98 1.26 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -166.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.591 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 33.8 Cg_exo -37.43 1.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.189 1 C-N-CA 127.92 5.747 . . . . 0.0 118.535 170.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.623 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.28 -38.35 0.22 Allowed 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.838 1.199 . . . . 0.0 113.892 -170.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.809 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -51.76 -50.33 60.85 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.4 . . . . 0.0 111.128 176.313 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.67 ' H ' ' HG2' ' A' ' 84' ' ' MET . 6.3 ptmt -88.2 -14.63 38.08 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.237 -0.29 . . . . 0.0 111.377 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.623 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 31.2 mt -59.71 -44.1 92.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.614 0.245 . . . . 0.0 110.846 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.862 ' HB2' HD11 ' A' ' 18' ' ' LEU . 42.6 t -65.89 -21.13 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.276 0.56 . . . . 0.0 111.211 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -82.88 -34.71 26.64 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.0 mttt -62.67 -31.42 72.3 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.478 0.656 . . . . 0.0 109.812 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 87' ' ' CYS . 74.1 mt -66.74 -14.8 63.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.951 -177.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 41.7 mtpt -67.2 -17.49 64.84 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.698 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -66.15 -29.77 70.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.563 . . . . 0.0 109.689 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 60.1 mt -90.42 -50.22 6.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.101 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 16.6 t70 -147.71 132.42 17.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.067 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.3 m -87.44 -20.79 26.12 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.424 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.1 tp60 -78.89 -30.12 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.739 -174.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.531 ' HB ' ' HB3' ' A' ' 58' ' ' TYR . 10.3 tt -54.25 -29.18 19.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.854 0.835 . . . . 0.0 110.109 173.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.633 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 45.1 t -86.3 -58.71 2.52 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.624 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -96.17 42.89 1.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.798 -173.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.2 tp -70.57 -56.63 6.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.956 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 69.38 135.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 O-C-N 124.122 0.889 . . . . 0.0 112.016 177.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -68.2 157.76 34.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.683 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -83.0 75.37 9.89 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.398 0.618 . . . . 0.0 110.549 -177.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HG2' ' H ' ' A' ' 104' ' ' LYS . 14.3 pttp -74.86 46.83 0.31 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.393 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 39.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.079 -178.81 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.62 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 0.2 OUTLIER -165.17 153.9 12.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.822 -166.32 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 16' ' ' GLU . . . -121.16 1.99 10.34 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.846 0.355 . . . . 0.0 110.487 176.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.2 105.99 1.38 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.469 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 106.07 -12.33 44.85 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.466 -175.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.437 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 41.1 mtt-85 -97.42 165.97 14.61 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -85.87 73.23 3.8 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.815 2.344 . . . . 0.0 109.999 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.952 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -78.65 -39.87 20.03 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.4 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HB1' ' CB ' ' A' ' 87' ' ' CYS . . . -173.67 -90.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.834 0.35 . . . . 0.0 110.347 -176.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -152.58 -71.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.584 ' HB2' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -81.18 146.52 30.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -46.78 -56.79 5.65 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -171.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.836 HG12 HD22 ' A' ' 55' ' ' LEU . 58.7 t -61.13 -50.98 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 117.958 0.345 . . . . 0.0 111.742 -173.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HA ' HD21 ' A' ' 55' ' ' LEU . 49.9 t -60.62 -33.87 73.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.525 0.678 . . . . 0.0 109.913 176.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.81 ' HG3' ' HA3' ' A' ' 8' ' ' GLY . 24.0 ttmt -67.17 -48.8 66.88 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.282 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.79 ' HA ' ' HB3' ' A' ' 3' ' ' ALA . 1.5 mm-40 -57.67 -42.93 84.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.843 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -66.35 -57.01 8.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 80.0 mt -67.18 -39.05 86.35 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.157 -173.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.952 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 27.3 t-20 -68.7 -55.9 9.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -176.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.62 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 67.1 mtm180 -64.28 -32.95 74.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.433 0.161 . . . . 0.0 111.433 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -64.12 -47.28 80.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.982 0.896 . . . . 0.0 109.622 174.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 49.8 t80 -57.96 -55.94 28.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.868 -177.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -71.46 -26.84 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.259 -176.493 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.41 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 46.1 t -65.91 -47.56 74.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.923 0.392 . . . . 0.0 110.2 176.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -60.07 -48.37 82.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.605 -179.314 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 22' ' ' TYR . 43.3 mm -62.2 -45.51 98.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.702 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -70.75 -38.13 73.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.374 -177.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.479 ' HB2' HG12 ' A' ' 30' ' ' VAL . 60.0 mtm180 -76.32 -13.64 60.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 111.726 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.51 38.31 57.85 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.7 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 1.9 p -125.07 91.31 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.295 -0.452 . . . . 0.0 110.042 -176.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -168.88 -170.29 1.14 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.026 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 62.38 35.11 15.17 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.605 ' O ' HG12 ' A' ' 37' ' ' ILE . 47.2 m -155.28 101.15 2.2 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.483 HD11 ' HD2' ' A' ' 75' ' ' ARG . 3.2 mm? -47.16 -43.94 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.16 -46.63 85.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.642 . . . . 0.0 110.458 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.6 m -71.14 -35.48 71.71 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.673 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 33' ' ' SER . 14.9 mm -55.4 -34.27 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.089 0.471 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -61.36 -47.79 84.26 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.914 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -66.63 -36.78 83.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.097 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -60.94 -53.28 59.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -57.42 -41.26 80.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.67 0.271 . . . . 0.0 110.692 177.611 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.01 -44.89 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.592 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.2 m -58.74 -46.32 87.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.024 0.44 . . . . 0.0 110.34 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -76.12 -17.45 59.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.6 t -69.01 -47.83 64.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.835 177.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.8 mm? -86.47 -31.22 21.47 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -72.09 -22.88 61.28 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.04 -164.29 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -98.62 173.11 7.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.305 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.89 -47.23 39.89 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 114.659 0.623 . . . . 0.0 114.659 -169.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.9 mptt -60.9 -37.06 80.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 117.153 0.476 . . . . 0.0 110.967 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 30.6 mt-10 -81.61 -34.79 30.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.888 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.434 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 33.2 m-20 -65.94 -23.9 66.7 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 9.2 tpp180 -86.92 -35.04 19.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.235 0.54 . . . . 0.0 109.694 172.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.836 HD22 HG12 ' A' ' 13' ' ' VAL . 29.8 tp -60.99 -36.39 79.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.333 -179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.639 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 21.6 p -65.72 -20.29 66.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.332 -178.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 45.7 m-85 -68.64 -30.94 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 97' ' ' ILE . 91.0 m-85 -85.3 -45.24 12.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.53 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.6 HD23 HD11 ' A' ' 97' ' ' ILE . 88.9 mt -68.7 -12.61 61.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.564 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 77.04 40.49 24.87 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.095 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -107.57 25.1 11.9 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.613 0.721 . . . . 0.0 110.281 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.1 t -149.03 141.76 24.54 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.295 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -80.04 -3.22 47.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 -174.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -92.88 7.95 41.73 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.16 -161.65 1.11 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.78 109.97 0.58 Allowed 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.443 0.464 . . . . 0.0 109.964 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -15.27 50.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.343 -173.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -66.5 -44.71 81.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.358 . . . . 0.0 110.568 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.859 HG23 ' HA3' ' A' ' 60' ' ' GLY . 16.7 tt -72.29 -21.52 20.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.756 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.1 tt -61.15 -46.9 88.63 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.485 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 8.6 m -66.36 -28.51 68.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.719 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 8.5 mm-40 -67.65 -58.26 4.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.708 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.587 ' O ' ' HB2' ' A' ' 77' ' ' MET . 60.9 t -62.32 -44.29 99.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.798 0.333 . . . . 0.0 111.6 -173.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.473 ' HA ' HG21 ' A' ' 37' ' ' ILE . 16.4 p -56.59 -32.56 65.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -176.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.485 ' HD3' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -61.32 -56.75 30.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.267 -175.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.942 ' HB2' ' HG2' ' A' ' 81' ' ' MET . 72.6 Cg_endo -78.77 -27.49 4.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 121.706 1.604 . . . . 0.0 113.444 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.587 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 0.3 OUTLIER -67.21 -19.21 65.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.801 0.334 . . . . 0.0 110.795 -178.067 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.8 t -68.34 -13.36 62.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.547 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.699 HG22 ' H ' ' A' ' 80' ' ' HIS . 5.9 p -129.23 179.25 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.699 ' H ' HG22 ' A' ' 79' ' ' VAL . 14.9 t-80 -55.02 -67.86 0.24 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 122.501 0.32 . . . . 0.0 110.226 -178.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.942 ' HG2' ' HB2' ' A' ' 76' ' ' PRO . 15.4 tpt 67.39 145.71 0.1 Allowed Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 164.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.863 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 42.5 Cg_exo -43.74 4.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.949 1 C-N-CA 127.661 5.574 . . . . 0.0 118.251 168.399 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.607 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.21 -31.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -158.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.83 ' SD ' ' HG3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.75 -45.18 83.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 120.028 1.285 . . . . 0.0 109.997 175.239 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.83 ' HG3' ' SD ' ' A' ' 84' ' ' MET . 90.1 mttt -63.82 -24.2 67.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.148 176.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.775 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 32.7 mt -61.76 -27.38 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.896 -174.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.722 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 18.6 t -75.59 -31.56 59.99 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.57 176.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 4.5 mm-40 -63.35 -43.24 98.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.185 173.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.775 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 0.0 OUTLIER -68.57 -33.94 74.95 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.415 176.084 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 15.5 mt -64.3 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.283 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 54.2 mtpt -67.33 -17.13 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.072 0.463 . . . . 0.0 110.854 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.423 ' HB3' ' O ' ' A' ' 89' ' ' LYS . 58.0 tttm -76.69 -25.53 53.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.772 175.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.65 -52.54 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.736 175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.662 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 11.7 t70 -139.49 134.19 31.93 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.051 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 m -85.71 -30.36 23.21 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -86.27 -14.82 42.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.6 HD11 HD23 ' A' ' 59' ' ' LEU . 14.5 tt -59.7 -27.61 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.027 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 45.4 t -83.12 -30.93 27.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.679 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.28 -94.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.398 -171.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.64 -68.28 0.12 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.544 0.528 . . . . 0.0 110.582 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.498 ' HB2' ' HD3' ' A' ' 104' ' ' LYS . 33.4 mmtp 64.24 117.32 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.668 0.747 . . . . 0.0 111.81 177.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.522 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 89.5 m-85 -59.95 -53.11 61.69 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.894 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -133.14 145.13 50.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.049 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.498 ' HD3' ' HB2' ' A' ' 101' ' ' LYS . 15.8 pttm -156.89 20.34 0.32 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.412 0.625 . . . . 0.0 110.402 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.25 1.09 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.371 176.955 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.799 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 4.2 pt20 . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.829 ' HA ' ' HD2' ' A' ' 6' ' ' ARG . 8.4 tp10 73.4 146.83 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 123.854 0.721 . . . . 0.0 111.365 175.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.8 47.39 0.49 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.9 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 72.45 58.47 4.99 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.602 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.51 55.25 6.18 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -173.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.829 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -43.0 105.86 0.45 Allowed Pre-proline 0 N--CA 1.463 0.192 0 CA-C-O 121.984 0.897 . . . . 0.0 112.691 -170.754 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.613 ' O ' ' HB3' ' A' ' 84' ' ' MET . 56.7 Cg_endo -89.65 63.46 2.21 Favored 'Trans proline' 0 N--CA 1.443 -1.446 0 C-N-CA 123.228 2.619 . . . . 0.0 110.184 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -73.77 -27.8 66.33 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.119 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . 177.78 -125.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 O-C-N 124.028 0.487 . . . . 0.0 110.624 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -128.41 -63.56 0.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HB3' ' HA ' ' A' ' 99' ' ' GLU . 18.9 m -70.17 124.66 24.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.243 171.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 3.0 mp0 -46.28 -49.16 17.77 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -169.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.912 HG12 HD22 ' A' ' 55' ' ' LEU . 61.5 t -70.11 -46.81 71.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -167.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 12.7 p -66.47 -30.08 70.34 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.644 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 19.6 ttmt -61.27 -54.7 40.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.6 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.631 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 59.9 mm-40 -52.22 -52.29 53.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.081 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -58.8 -55.4 35.56 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.771 -176.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 87' ' ' CYS . 85.6 mt -63.07 -44.15 96.58 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.991 -172.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.544 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -65.61 -49.04 70.18 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 123.143 0.277 . . . . 0.0 111.538 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.799 ' HD2' ' HA ' ' A' ' 1' ' ' GLN . 10.5 mtm180 -71.33 -35.89 71.37 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.714 -175.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -64.18 -44.09 93.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.487 0.66 . . . . 0.0 109.497 174.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.521 ' O ' HG12 ' A' ' 26' ' ' ILE . 66.7 t80 -54.81 -55.54 29.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.377 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -70.73 -27.63 64.1 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.972 -178.089 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.477 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 51.4 m -63.37 -52.87 59.88 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.744 176.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.75 HD23 HD22 ' A' ' 31' ' ' ASN . 3.1 mp -60.69 -36.59 79.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.484 0.183 . . . . 0.0 111.38 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.4 mm -67.63 -52.53 39.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.72 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -70.83 -35.01 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.664 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.619 ' HB2' HG12 ' A' ' 30' ' ' VAL . 64.2 mtp180 -75.06 -14.49 60.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.021 0.439 . . . . 0.0 111.242 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.66 40.12 85.89 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.526 -0.629 . . . . 0.0 111.526 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.681 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 3.4 p -127.42 56.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-O 122.519 1.152 . . . . 0.0 110.13 -173.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.75 HD22 HD23 ' A' ' 25' ' ' LEU . 12.8 t-20 -143.68 -163.64 1.7 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.583 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.453 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 94.1 m-85 60.73 30.14 19.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.512 0.673 . . . . 0.0 110.879 -176.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.51 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 32.7 m -153.15 112.84 3.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.745 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.2 mm? -61.85 -41.28 97.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.34 -172.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.48 -27.29 64.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.153 0.501 . . . . 0.0 110.389 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.51 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.0 m -73.88 -45.97 47.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.747 178.071 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 33' ' ' SER . 45.0 mt -61.32 -34.3 60.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -73.41 -25.52 60.57 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.375 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -85.6 -44.86 12.26 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.063 0.458 . . . . 0.0 110.263 176.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -65.89 -35.77 81.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.596 -176.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.778 HD13 HD11 ' A' ' 70' ' ' LEU . 16.4 mt -55.96 -40.05 72.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.273 0.559 . . . . 0.0 109.645 172.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 51.4 mt -72.72 -38.39 58.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.397 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 t -75.25 -50.78 15.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.969 0.414 . . . . 0.0 110.73 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -62.83 -30.92 71.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.027 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 15.6 m -68.07 -27.85 66.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -89.18 -15.18 34.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.218 0.532 . . . . 0.0 110.507 173.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.32 -22.2 41.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.534 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.782 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -76.94 -168.18 1.01 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.813 179.231 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -93.84 167.97 11.29 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.32 -46.53 35.53 Favored Glycine 0 CA--C 1.517 0.197 0 O-C-N 123.662 0.601 . . . . 0.0 114.442 -171.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 100' ' ' LEU . 16.7 tppt? -59.35 -38.79 81.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 117.146 0.473 . . . . 0.0 110.33 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.782 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.5 mt-10 -80.37 -36.49 33.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.204 -176.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -59.28 -47.79 84.04 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 174.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -68.13 -37.5 81.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.48 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.912 HD22 HG12 ' A' ' 13' ' ' VAL . 33.8 tp -52.72 -38.6 61.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.088 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 68.5 m -71.87 -15.04 62.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -73.19 -23.11 60.37 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.497 ' HB3' HG13 ' A' ' 97' ' ' ILE . 89.4 m-85 -85.33 -46.7 10.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.55 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.859 ' HA ' HD11 ' A' ' 97' ' ' ILE . 86.9 mt -62.21 -24.66 67.36 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.702 -178.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.76 7.11 61.72 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.626 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.407 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -90.49 59.85 4.43 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.451 0.643 . . . . 0.0 110.822 -178.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.3 t -166.11 146.93 6.57 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.449 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -87.2 24.42 1.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.527 0.68 . . . . 0.0 110.445 -176.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -125.72 13.83 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.205 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -141.46 -176.0 4.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.721 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -73.89 88.78 1.84 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.965 0.412 . . . . 0.0 111.155 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -18.84 65.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.801 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -61.28 -21.72 64.2 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 66' ' ' ALA . 10.9 pt -85.44 -14.48 10.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.089 0.471 . . . . 0.0 110.48 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.778 HD11 HD13 ' A' ' 41' ' ' LEU . 21.8 tp -69.88 -15.42 63.07 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.876 -171.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.416 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 2.8 p -61.12 -29.66 69.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.535 174.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 58.6 mm-40 -63.47 -29.11 70.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.387 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.477 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.2 t -88.41 -56.79 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.192 0.52 . . . . 0.0 111.122 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 6.6 p -53.14 -47.83 68.39 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.283 -172.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.585 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.4 mpt_? -65.09 -51.78 52.91 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.7 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 45.9 Cg_exo -61.76 -34.96 81.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.549 1.499 . . . . 0.0 113.247 175.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 21.0 mmt -68.08 -13.55 62.29 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.2 t -67.7 -13.47 62.12 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -175.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.516 HG13 ' H ' ' A' ' 80' ' ' HIS . 2.8 p -134.77 -62.23 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.516 ' H ' HG13 ' A' ' 79' ' ' VAL . 13.4 t60 -176.33 -89.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -173.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.7 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 49.5 mtp 68.11 167.56 0.12 Allowed Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 163.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 4.9 Cg_endo -44.92 4.02 0.01 OUTLIER 'Trans proline' 0 C--O 1.205 -1.151 1 C-N-CA 127.987 5.791 . . . . 0.0 117.969 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -34.6 -26.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -148.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.624 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -54.21 -42.98 70.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 120.471 1.487 . . . . 0.0 109.744 166.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.761 ' HB3' ' HB2' ' A' ' 82' ' ' PRO . 23.9 ttmm -71.1 -17.71 62.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.966 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 83' ' ' ALA . 66.9 mt -64.84 -25.39 37.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.414 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.6 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 51.0 t -80.32 -30.58 38.15 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.59 173.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.53 -40.65 93.19 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 8.1 tppt? -57.96 -47.51 82.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.74 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 97' ' ' ILE . 16.4 mt -65.67 -24.56 67.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.055 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.6 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 39.8 mtpt -69.99 -14.99 62.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.834 -177.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 34.9 pttt -73.94 -22.75 59.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.189 -0.605 . . . . 0.0 109.405 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -87.92 -45.88 9.87 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.913 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 10.5 t70 -142.46 138.02 30.72 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.689 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.2 m -87.02 -28.04 22.85 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -175.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -85.88 -14.23 45.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.114 0.483 . . . . 0.0 110.911 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.859 HD11 ' HA ' ' A' ' 59' ' ' LEU . 18.8 tt -55.02 -27.21 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.089 -175.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 14' ' ' CYS . 15.8 p -85.39 -38.88 18.21 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -169.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.677 ' HG3' ' H ' ' A' ' 100' ' ' LEU . 6.5 pt-20 -79.58 -98.43 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.121 -170.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.677 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 94.5 mt 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 117.841 0.292 . . . . 0.0 110.326 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.476 ' HB3' ' N ' ' A' ' 105' ' ' THR . 34.7 mmtp -49.64 134.98 19.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.53 -174.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -61.86 -68.18 0.34 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.0 110.556 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -116.03 54.01 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.267 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER 68.44 2.93 3.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.199 -169.704 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.476 ' N ' ' HB3' ' A' ' 101' ' ' LYS . 15.2 t . . . . . 0 C--O 1.246 0.889 0 CA-C-N 114.997 -1.001 . . . . 0.0 108.374 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 120.057 -0.02 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.407 ' HG3' HH21 ' A' ' 6' ' ' ARG . 8.8 pt-20 179.66 141.25 0.13 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 111.093 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.412 ' HB1' ' O ' ' A' ' 6' ' ' ARG . . . -87.56 -70.76 0.6 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 167.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.37 -103.43 0.26 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 121.346 -0.454 . . . . 0.0 112.47 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.42 -22.92 69.87 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 111.766 -0.534 . . . . 0.0 111.766 175.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.46 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 59.4 mtm-85 -85.73 137.44 36.0 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-O 120.832 0.349 . . . . 0.0 110.062 175.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 36.6 Cg_endo -97.48 105.41 0.08 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 123.824 3.016 . . . . 0.0 111.317 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.518 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -90.32 -32.46 9.56 Favored Glycine 0 N--CA 1.436 -1.301 0 C-N-CA 119.111 -1.519 . . . . 0.0 111.733 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -166.21 -81.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.892 0.377 . . . . 0.0 110.232 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -176.48 -47.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.825 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.7 p -66.21 -90.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.357 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 31.2 tt0 -172.45 -81.68 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.926 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -56.86 -45.08 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 111.488 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.5 t -64.69 -35.42 80.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.852 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 13.3 ptpt -71.82 -37.73 70.28 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.108 0.48 . . . . 0.0 109.717 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.582 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 78.2 mm-40 -58.82 -51.31 70.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.335 178.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.38 -55.63 26.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.572 -176.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 86.5 mt -59.79 -43.19 94.54 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.62 0.248 . . . . 0.0 111.506 -174.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 14.4 t-20 -74.76 -44.01 51.9 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.865 -176.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 7.0 tpp85 -55.2 -51.2 67.32 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.271 0.557 . . . . 0.0 110.158 175.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CD2' ' SD ' ' A' ' 77' ' ' MET . 29.6 t80 -59.57 -42.63 92.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.659 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -52.96 -57.01 11.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.513 178.7 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -76.18 -30.94 58.26 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.755 -173.662 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 4.8 t -68.34 -36.73 79.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.937 0.399 . . . . 0.0 110.288 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -67.21 -42.95 83.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.43 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -63.69 -43.31 98.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.085 175.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -55.86 -55.53 31.38 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.085 0.469 . . . . 0.0 110.777 177.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.4 mtm-85 -66.78 -17.35 64.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.163 -177.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.51 31.52 33.32 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.583 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.733 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -131.04 100.69 4.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.074 -175.109 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -168.8 -170.58 1.2 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.9 t80 73.9 -49.57 0.68 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.784 0.834 . . . . 0.0 111.545 176.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 3.9 m -66.95 114.99 6.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.942 0.401 . . . . 0.0 110.317 177.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.693 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -58.39 -45.15 88.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.983 -176.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -28.52 69.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.266 0.555 . . . . 0.0 110.431 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.3 m -79.78 -45.49 18.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.524 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' SER . 37.4 mt -60.11 -27.93 40.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -64.12 -41.53 97.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.773 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 18.8 mmmt -74.22 -45.52 47.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.686 0.755 . . . . 0.0 109.981 -179.197 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.92 -33.45 75.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.743 -1.117 . . . . 0.0 111.769 -174.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 24.2 tp -59.8 -29.24 68.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.551 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 81.4 mt -84.48 -50.5 14.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.297 175.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -55.42 -37.93 68.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.981 -178.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -71.63 -33.81 69.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.721 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.551 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 26.6 p -85.41 -13.46 49.28 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 119.926 -0.709 . . . . 0.0 111.52 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.8 tp -86.58 -22.17 26.43 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 170.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -81.99 -23.22 36.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.041 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -79.89 -172.32 3.32 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.542 -175.062 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -99.23 173.85 6.59 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.853 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.14 -41.38 38.39 Favored Glycine 0 C--N 1.332 0.308 0 N-CA-C 114.993 0.757 . . . . 0.0 114.993 -169.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.9 tppt? -60.81 -43.54 98.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 0.0 109.955 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 19.1 mt-10 -80.45 -32.5 37.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.58 -174.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.63 -52.49 64.15 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -63.28 -35.63 81.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.486 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.926 HD22 HG12 ' A' ' 13' ' ' VAL . 52.1 tp -56.52 -33.57 66.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.029 177.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.793 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 51.3 t -70.67 -25.32 62.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.378 -177.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.531 ' CZ ' HG21 ' A' ' 62' ' ' THR . 64.3 m-85 -69.05 -28.14 66.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.207 0.527 . . . . 0.0 109.708 174.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.548 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.1 m-85 -86.83 -34.27 19.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.926 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.3 mt -71.51 -14.87 62.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.826 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.579 ' HA3' HD11 ' A' ' 69' ' ' ILE . . . 91.22 11.85 60.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.899 -0.667 . . . . 0.0 113.744 171.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.793 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -84.02 -43.29 15.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.006 0.403 . . . . 0.0 111.107 -178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.531 HG21 ' CZ ' ' A' ' 57' ' ' TYR . 1.2 m -64.65 154.41 36.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -178.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -80.3 49.18 1.09 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.901 0.381 . . . . 0.0 111.659 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.86 46.01 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.414 ' CB ' ' HA2' ' A' ' 60' ' ' GLY . . . -148.79 -167.77 2.92 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.169 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.9 123.17 21.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -76.34 -29.82 57.39 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -84.85 -29.75 25.05 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.579 HD11 ' HA3' ' A' ' 60' ' ' GLY . 24.2 pt -68.17 -16.89 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 120.758 0.313 . . . . 0.0 111.287 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 70' ' ' LEU . 3.0 tt -63.23 -37.98 89.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.9 m -68.39 -24.59 64.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.667 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.07 -24.93 65.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.009 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.499 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 59.0 t -87.57 -57.71 4.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 0.0 110.937 175.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.416 HG22 ' CG2' ' A' ' 37' ' ' ILE . 12.4 p -54.61 -54.97 34.48 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -173.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.693 ' HA ' HD11 ' A' ' 34' ' ' LEU . 9.3 mpt_? -54.4 -50.9 82.45 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 123.234 0.334 . . . . 0.0 111.867 -174.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.499 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 32.3 Cg_exo -64.96 -45.39 8.11 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 121.33 1.353 . . . . 0.0 112.707 173.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.429 ' SD ' ' CD2' ' A' ' 21' ' ' PHE . 53.5 ttm -65.25 -13.19 57.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.79 0.329 . . . . 0.0 111.812 -175.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.1 m -58.66 -19.25 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.726 175.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.465 HG13 ' HG2' ' A' ' 81' ' ' MET . 10.7 p -141.53 167.65 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 174.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -70.05 110.02 4.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.883 -0.51 . . . . 0.0 110.15 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.753 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 21.9 mmm -130.31 172.94 6.42 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -167.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.753 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.7 Cg_exo -39.19 1.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.824 1 C-N-CA 127.89 5.727 . . . . 0.0 118.68 171.032 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -39.83 -26.09 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -168.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.72 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.17 -41.3 79.0 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 122.129 0.966 . . . . 0.0 109.269 172.045 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 29.5 mtpt -85.26 -22.55 28.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.078 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.578 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 58.8 mt -66.93 -33.26 62.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 C-N-CA 120.399 -0.521 . . . . 0.0 109.878 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.497 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 34.6 t -62.63 -31.97 72.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.187 0.518 . . . . 0.0 110.299 173.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.661 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 33.8 tt0 -68.5 -34.82 76.56 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.684 177.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.213 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.28 -42.53 30.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.416 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.661 ' HG3' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -69.75 -13.77 62.45 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.819 0.342 . . . . 0.0 110.642 179.822 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -59.72 -37.75 79.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.157 0.503 . . . . 0.0 109.744 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.0 -46.52 18.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.815 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.592 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 15.2 t70 -142.34 108.16 5.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.939 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.615 ' HA ' ' HB2' ' A' ' 91' ' ' LYS . 13.0 t -73.48 -17.0 61.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.209 -175.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 92.5 mt-30 -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.64 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.548 HG12 ' HB3' ' A' ' 58' ' ' TYR . 84.0 mt -56.79 -48.84 80.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.575 0.702 . . . . 0.0 110.26 173.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.49 -48.87 13.15 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.814 -177.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -87.58 37.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.039 -176.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.656 HD23 HG11 ' A' ' 13' ' ' VAL . 21.3 tp -74.05 -57.18 4.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 65.13 122.45 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.207 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.47 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 96.6 m-85 -61.3 -60.36 3.86 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.269 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 47.3 mm-40 -101.13 -70.09 0.75 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 2.6 tppp? 172.77 127.43 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.597 177.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.749 -0.644 . . . . 0.0 109.873 177.127 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.675 ' HA ' ' HB3' ' A' ' 23' ' ' LYS . 5.7 tp-100 . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.457 0.17 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.49 ' OE2' ' HG2' ' A' ' 23' ' ' LYS . 2.0 mp0 -52.46 96.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 168.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.14 66.98 0.64 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.49 -108.91 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.199 -0.761 . . . . 0.0 111.199 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -121.54 62.27 0.52 Allowed Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.161 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.443 ' NH1' ' HG3' ' A' ' 2' ' ' GLU . 18.2 tpp180 56.12 78.71 0.37 Allowed Pre-proline 0 CA--C 1.534 0.353 0 CA-C-O 121.311 0.576 . . . . 0.0 111.458 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.91 58.28 4.42 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.111 2.541 . . . . 0.0 110.621 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.893 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -77.82 -34.72 37.76 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.283 -175.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -169.12 -92.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.931 0.396 . . . . 0.0 111.165 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -155.19 -47.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.259 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -76.12 -107.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 5.1 tp10 -153.84 -72.97 0.13 Allowed 'General case' 0 C--O 1.219 -0.5 0 O-C-N 122.105 -0.372 . . . . 0.0 111.457 -175.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 55' ' ' LEU . 77.7 t -57.75 -55.27 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.559 ' HA ' ' CD1' ' A' ' 55' ' ' LEU . 35.4 t -59.53 -35.44 74.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.479 0.657 . . . . 0.0 110.441 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.57 ' HG3' ' H ' ' A' ' 8' ' ' GLY . 6.3 ttmt -67.7 -46.52 72.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.755 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.593 ' HB3' HH21 ' A' ' 20' ' ' ARG . 26.0 mm-40 -57.41 -53.79 54.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.961 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -56.98 -55.37 35.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.246 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 69.8 mt -61.44 -55.35 32.29 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 120.533 0.206 . . . . 0.0 111.46 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.893 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 26.3 t-20 -66.47 -45.53 79.41 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 16' ' ' GLU . 18.6 ttp85 -67.3 -39.04 85.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.438 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -61.33 -46.15 91.47 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 122.308 1.052 . . . . 0.0 109.192 174.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.746 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.2 t80 -55.76 -38.08 69.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 112.864 -1.971 . . . . 0.0 111.974 -175.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.675 ' HB3' ' HA ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -85.46 -28.98 24.67 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.476 178.023 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.591 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 69.0 m -59.9 -40.26 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.886 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.7 mp -69.66 -25.02 63.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.375 179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.0 mm -78.76 -51.61 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.97 -46.4 89.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.177 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.484 ' HB2' HG12 ' A' ' 30' ' ' VAL . 53.2 mtp85 -72.92 -13.64 61.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.009 -177.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.75 45.08 54.65 Favored Glycine 0 C--N 1.332 0.344 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.713 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 6.0 p -138.26 51.21 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 0 CA-C-O 122.378 1.085 . . . . 0.0 109.883 -170.03 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -130.82 179.96 5.66 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.593 -0.692 . . . . 0.0 111.345 -172.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.586 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 71.0 m-85 72.28 -48.14 0.68 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.978 0.911 . . . . 0.0 112.131 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 15.0 m -64.43 104.85 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.44 -41.34 72.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.854 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -63.32 -34.15 77.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.597 0.713 . . . . 0.0 110.197 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 85.9 m -79.71 -43.94 21.73 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.259 -178.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 33' ' ' SER . 67.5 mt -59.34 -31.74 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG3' HD21 ' A' ' 70' ' ' LEU . 35.2 tt0 -61.37 -55.13 34.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.812 175.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' HD12 ' A' ' 42' ' ' ILE . 21.9 tptm -67.13 -35.28 79.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.212 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.06 -34.59 73.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.196 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 41' ' ' LEU . 11.5 mt -61.01 -41.65 96.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 172.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 39' ' ' LYS . 99.0 mt -59.57 -48.67 86.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.735 175.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 t -63.76 -48.71 75.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.891 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.547 ' HZ ' ' HG2' ' A' ' 20' ' ' ARG . 11.3 t80 -63.95 -34.57 78.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.28 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -60.44 -33.25 72.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.632 176.868 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -86.87 -39.39 15.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.44 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.18 -15.66 60.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.931 -173.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.766 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.97 -171.17 0.83 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.865 0.364 . . . . 0.0 111.466 178.849 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.24 164.34 13.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.424 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -47.61 -41.47 18.73 Favored Glycine 0 C--N 1.331 0.253 0 O-C-N 123.661 0.601 . . . . 0.0 114.1 -171.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -61.05 -43.22 99.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.222 0.534 . . . . 0.0 110.569 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 21.0 mt-10 -79.04 -30.42 44.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.171 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -63.57 -18.89 64.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 40.6 mmt180 -86.61 -46.27 10.25 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.858 172.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.64 HD13 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -62.46 -25.13 67.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.775 -174.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.632 ' N ' HD23 ' A' ' 55' ' ' LEU . 25.7 p -72.66 -14.75 61.65 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.255 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.501 ' HA ' ' OG1' ' A' ' 62' ' ' THR . 66.9 m-85 -72.72 -33.72 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.173 0.511 . . . . 0.0 109.626 171.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.417 ' HD2' ' HA ' ' A' ' 55' ' ' LEU . 60.0 m-85 -85.58 -29.24 24.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.569 HD13 ' HG ' ' A' ' 55' ' ' LEU . 8.1 mp -80.23 -6.04 57.18 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.852 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.55 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 84.43 -0.8 89.24 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.233 176.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -80.07 42.54 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.148 0.499 . . . . 0.0 111.465 -177.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.501 ' OG1' ' HA ' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -145.17 133.3 21.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.899 -179.232 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.25 -7.7 52.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.74 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -90.5 -18.51 25.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.262 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.71 -160.75 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.377 -175.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.67 132.56 35.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.105 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 p -85.32 -18.09 34.88 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -77.96 -24.07 48.28 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.439 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' HA3' ' A' ' 60' ' ' GLY . 17.3 tt -85.09 -23.84 7.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.309 0.576 . . . . 0.0 109.653 173.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.494 HD21 ' HG3' ' A' ' 38' ' ' GLU . 41.1 tp -63.06 -42.7 99.75 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.094 175.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 p -69.17 -15.42 63.4 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.877 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.547 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 53.8 mm-40 -77.82 -56.67 4.31 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.672 177.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.45 -34.02 67.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-O 120.973 0.416 . . . . 0.0 111.748 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.417 HG22 HG22 ' A' ' 37' ' ' ILE . 7.6 p -57.33 -27.52 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -74.17 -54.49 3.36 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.861 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.547 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 23.9 Cg_endo -64.74 -17.73 60.4 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.653 1.569 . . . . 0.0 113.195 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.5 mmt -75.69 -16.53 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.473 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.586 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 34.1 t -86.19 -52.77 5.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.861 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.562 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.3 p -109.06 142.34 21.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.011 -176.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.746 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 72.5 m80 -57.15 111.37 1.04 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.844 0.354 . . . . 0.0 110.593 -177.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.562 ' HG3' HG13 ' A' ' 79' ' ' VAL . 32.1 mtp -140.8 170.08 10.24 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -168.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.437 ' C ' HG13 ' A' ' 86' ' ' ILE . 30.1 Cg_exo -41.0 0.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.828 1 C-N-CA 127.623 5.549 . . . . 0.0 118.093 171.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.469 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -38.17 -38.61 0.35 Allowed 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 120.195 1.361 . . . . 0.0 114.522 -169.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.4 OUTLIER -60.64 -38.17 83.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.891 -0.506 . . . . 0.0 110.766 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.499 ' N ' ' HG2' ' A' ' 84' ' ' MET . 51.6 mttm -86.25 -22.97 26.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.221 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.469 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 25.8 mt -62.17 -33.1 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.161 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.567 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 41.8 t -63.86 -36.1 82.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.167 0.508 . . . . 0.0 110.604 174.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.7 mt-10 -66.81 -39.14 87.6 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.703 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -62.38 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.678 175.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 93' ' ' LEU . 14.6 mt -60.28 -31.59 70.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.595 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 9.5 mtpm? -65.2 -19.31 65.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.25 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -23.93 50.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 109.789 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.7 mp -84.39 -52.84 5.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.745 175.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -144.16 132.48 21.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.982 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -85.1 -18.45 34.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -174.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.704 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 78.7 mt-30 -67.61 -33.18 74.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.569 0.223 . . . . 0.0 110.644 -178.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 63.5 mt -46.31 -48.96 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.14 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -34.93 15.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.685 -177.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.671 ' HA ' ' HE3' ' A' ' 101' ' ' LYS . 16.3 mm-40 -89.55 21.15 3.55 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -171.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.752 ' HB3' ' HG3' ' A' ' 51' ' ' LYS . 34.0 mt -67.72 -54.22 21.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.443 173.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.671 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 30.0 mmtp 70.18 139.71 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.753 0.787 . . . . 0.0 112.47 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.93 83.13 2.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 59.28 99.93 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 O-C-N 123.934 0.771 . . . . 0.0 111.419 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -79.3 36.42 0.3 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.666 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.438 -179.975 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 61.47 72.52 0.51 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.591 0.71 . . . . 0.0 109.626 -178.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.27 113.32 17.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.701 -173.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 66.15 32.38 82.12 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.37 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.548 ' O ' ' HD2' ' A' ' 6' ' ' ARG . . . 87.2 -131.13 10.4 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.24 -176.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.579 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 14.9 mmm180 -124.7 59.05 19.42 Favored Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 117.001 0.4 . . . . 0.0 111.47 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.54 ' HD3' ' C ' ' A' ' 5' ' ' GLY . 93.9 Cg_endo -103.14 47.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 123.259 2.639 . . . . 0.0 111.654 -179.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.646 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -77.46 -27.43 59.4 Favored Glycine 0 CA--C 1.507 -0.433 0 C-N-CA 119.316 -1.421 . . . . 0.0 112.088 -171.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 1.017 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -171.29 -97.77 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.756 0.312 . . . . 0.0 110.881 177.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -161.75 176.91 10.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 82.9 m 60.62 -85.57 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 123.213 0.605 . . . . 0.0 111.129 -175.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.796 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 37.0 tt0 -179.61 -76.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.925 HG12 HD22 ' A' ' 55' ' ' LEU . 90.6 t -60.4 -39.58 81.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -167.177 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 98' ' ' CYS . 5.7 p -70.98 -32.21 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.049 178.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.796 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.8 ptmt -73.81 -31.14 63.11 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -177.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.33 -51.81 64.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.147 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 44' ' ' PHE . 44.0 t80 -60.53 -53.19 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.041 -179.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.607 HD12 ' HB2' ' A' ' 9' ' ' ALA . 84.7 mt -58.82 -47.61 84.21 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.126 0.266 . . . . 0.0 111.549 -174.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.514 ' HB2' ' CA ' ' A' ' 8' ' ' GLY . 29.0 t-20 -60.2 -49.46 77.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.716 0.293 . . . . 0.0 111.181 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -61.12 -46.06 92.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.275 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -65.83 -47.65 74.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.172 0.511 . . . . 0.0 110.601 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.479 ' O ' HG12 ' A' ' 26' ' ' ILE . 64.1 t80 -51.33 -50.27 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.713 -178.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.531 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -78.52 -33.11 48.2 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.543 -176.583 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 8.4 t -62.68 -36.02 81.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 0.0 110.786 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.824 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.8 mp -72.91 -27.53 61.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.929 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -76.2 -32.97 23.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.51 -57.13 10.06 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.529 0.68 . . . . 0.0 110.502 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -75.23 -21.43 58.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.486 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.97 45.91 90.9 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.422 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 ' HG ' ' A' ' 25' ' ' LEU . 2.8 m -96.93 4.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.541 0.686 . . . . 0.0 111.461 -173.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.465 HD21 HD23 ' A' ' 25' ' ' LEU . 20.9 m120 -82.56 -171.32 3.42 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.972 -170.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 92.7 m-85 71.76 -34.9 0.31 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.502 0.721 . . . . 0.0 111.252 -176.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 16.6 m -88.09 103.02 15.35 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.6 mm? -59.09 -38.99 80.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.243 -176.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.4 -38.07 85.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.067 0.461 . . . . 0.0 110.674 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.506 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 23.0 m -73.7 -46.14 47.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.757 -178.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.436 HG22 HG22 ' A' ' 74' ' ' THR . 48.1 mt -59.97 -31.63 48.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.476 0.655 . . . . 0.0 109.281 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -70.09 -43.67 70.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.652 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HD3' ' C ' ' A' ' 39' ' ' LYS . 12.7 tmtt? -66.92 -42.06 86.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.076 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HG3' HG21 ' A' ' 30' ' ' VAL . 55.3 mm-40 -67.72 -33.51 75.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.486 -179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.611 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 13.1 mt -54.0 -51.75 62.95 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 170.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.69 -49.78 81.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -58.83 -48.76 80.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.504 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.403 ' HD2' ' CE2' ' A' ' 17' ' ' PHE . 14.7 t80 -67.33 -31.37 71.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.881 0.372 . . . . 0.0 110.187 -175.209 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 62.8 m -64.68 -37.91 89.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.64 177.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 46' ' ' LEU . 2.0 tm? -86.06 -36.46 19.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.131 0.491 . . . . 0.0 110.512 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.33 -22.16 66.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.0 -175.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.764 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -76.76 -169.44 1.27 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.635 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -97.82 175.74 6.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.645 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.91 -40.94 35.74 Favored Glycine 0 CA--C 1.518 0.276 0 O-C-N 123.621 0.576 . . . . 0.0 114.463 -170.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 102' ' ' TYR . 0.2 OUTLIER -62.2 -50.85 70.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.07 0.435 . . . . 0.0 110.484 -179.648 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.764 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 1.6 mp0 -71.75 -34.23 69.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.621 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -57.44 -45.6 84.5 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -71.61 -37.61 70.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.39 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.925 HD22 HG12 ' A' ' 13' ' ' VAL . 22.9 tp -53.75 -32.59 52.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.555 178.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 32.6 t -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -176.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.49 -29.76 62.7 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.572 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.458 ' HB3' HG13 ' A' ' 97' ' ' ILE . 87.7 m-85 -74.68 -44.59 49.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.406 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.697 HD23 HD11 ' A' ' 97' ' ' ILE . 77.6 mt -67.28 -27.77 67.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.012 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' HA3' HG21 ' A' ' 69' ' ' ILE . . . 91.56 -9.65 76.61 Favored Glycine 0 C--O 1.225 -0.462 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.756 172.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.648 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -67.14 -16.16 64.15 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.159 0.48 . . . . 0.0 112.264 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -72.04 138.72 48.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -74.52 47.34 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.24 0.543 . . . . 0.0 111.552 -176.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -132.4 -32.3 1.35 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.516 178.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.12 -161.23 0.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.622 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 69' ' ' ILE . . . -63.32 140.17 58.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 174.275 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' HD13 ' A' ' 70' ' ' LEU . 33.3 p -85.74 -24.49 26.88 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -69.13 -30.05 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.39 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 66' ' ' ALA . 19.5 tt -66.71 -22.6 29.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.779 0.323 . . . . 0.0 110.654 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' A' ' 67' ' ' THR . 10.3 mp -61.02 -53.26 59.45 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.64 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 4.4 p -65.92 -34.02 77.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.544 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -58.65 -31.15 67.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.646 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.28 -46.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.991 0.424 . . . . 0.0 110.649 175.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.64 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 46.5 p -59.47 -36.04 75.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 71' ' ' SER . 1.5 mpp_? -58.93 -55.81 42.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.214 -178.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.61 -39.75 20.11 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.266 1.311 . . . . 0.0 112.421 175.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.1 mmt -60.27 -19.5 55.08 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.3 t -62.3 -14.97 44.74 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.553 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -151.47 175.75 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -176.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.553 ' H ' HG22 ' A' ' 79' ' ' VAL . 12.8 m-70 -64.43 122.44 16.75 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 43.0 mmm -140.71 167.9 16.18 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -170.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 76.3 Cg_exo -46.46 0.4 0.02 OUTLIER 'Trans proline' 0 C--O 1.208 -1.016 1 C-N-CA 126.966 5.11 . . . . 0.0 117.3 176.09 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.574 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -35.9 -40.18 0.18 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 -156.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' MET . . . . . 1.017 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.21 -36.17 68.13 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.672 0.669 . . . . 0.0 110.826 174.624 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 19.1 mtpp -85.12 -20.43 30.33 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.369 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 32.7 mt -64.42 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.516 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.695 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 51.6 t -66.42 -22.2 66.22 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.743 177.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.2 mt-10 -75.74 -37.98 58.88 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.592 175.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.59 -30.82 71.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.031 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' CYS . 93.4 mt -70.09 -14.97 62.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.247 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 30.7 mtpp -67.81 -17.55 64.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.701 0.286 . . . . 0.0 110.645 178.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -69.51 -28.14 65.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 0.0 109.896 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.0 mp -88.58 -48.7 7.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.581 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 8.8 t70 -146.44 126.23 13.5 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.9 m -78.21 -26.21 47.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.68 0.276 . . . . 0.0 111.517 -174.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.4 -12.57 51.75 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.598 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.697 HD11 HD23 ' A' ' 59' ' ' LEU . 17.7 tt -48.35 -34.05 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.595 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 30.5 p -82.36 -28.45 31.54 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.102 -176.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -79.18 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.422 -171.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 8.5 mp 64.48 -62.07 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.365 0.666 . . . . 0.0 111.475 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 69.8 mmtt 69.47 129.0 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.39 0.676 . . . . 0.0 111.141 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.462 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 80.4 m-85 -69.1 -167.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.049 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -67.53 -19.72 65.33 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.234 -0.291 . . . . 0.0 111.0 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 tppp? 73.15 0.41 3.67 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 123.809 0.693 . . . . 0.0 109.975 178.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 44.8 m . . . . . 0 C--O 1.247 0.956 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.884 -166.817 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.45 ' HA ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.556 ' HA ' ' OD1' ' A' ' 19' ' ' ASN . 44.2 mt-10 60.09 -169.68 0.15 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.349 0.406 . . . . 0.0 111.412 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.441 ' HB3' ' CG ' ' A' ' 7' ' ' PRO . . . 178.74 87.58 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.688 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.27 -83.8 1.08 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.588 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -127.81 36.85 2.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.852 -0.69 . . . . 0.0 112.167 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.425 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 75.0 mtt180 54.23 83.44 0.23 Allowed Pre-proline 0 N--CA 1.466 0.345 0 CA-C-O 121.264 0.554 . . . . 0.0 111.305 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.441 ' CG ' ' HB3' ' A' ' 3' ' ' ALA . 2.5 Cg_endo -83.87 56.81 5.28 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.39 2.727 . . . . 0.0 111.102 -173.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.632 ' HA3' ' HA ' ' A' ' 15' ' ' LYS . . . -71.92 -23.96 77.26 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.587 -0.816 . . . . 0.0 111.801 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -167.34 -93.95 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 120.714 0.292 . . . . 0.0 111.565 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -164.16 -32.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.793 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.84 -90.09 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.232 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 43.3 tt0 -170.81 -76.73 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.767 HG12 HD22 ' A' ' 55' ' ' LEU . 26.4 t -60.32 -46.13 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 111.11 -173.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.62 ' HA ' HD21 ' A' ' 55' ' ' LEU . 45.6 t -63.98 -28.89 70.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.374 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.632 ' HA ' ' HA3' ' A' ' 8' ' ' GLY . 55.1 mtpt -65.1 -50.46 66.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.596 0.712 . . . . 0.0 109.608 174.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.5 mm-40 -54.51 -55.15 32.08 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.371 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.452 ' HB2' HD23 ' A' ' 55' ' ' LEU . 24.4 t80 -58.28 -55.67 31.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.637 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.489 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 92.4 mt -61.98 -48.05 82.1 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -173.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.556 ' OD1' ' HA ' ' A' ' 2' ' ' GLU . 4.3 t-20 -69.6 -42.85 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.258 0.551 . . . . 0.0 110.686 -176.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -70.74 -36.84 73.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.203 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -59.36 -45.86 90.25 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.544 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -52.68 -56.79 12.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.451 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -69.69 -25.12 63.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.791 -175.499 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.574 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 74.4 m -67.76 -56.02 10.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.864 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.646 HD12 HG22 ' A' ' 30' ' ' VAL . 3.9 mm? -61.01 -39.02 88.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.275 -177.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' TYR . 47.4 mm -65.83 -37.29 79.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.867 0.365 . . . . 0.0 110.81 177.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.84 -45.0 65.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.777 ' HG3' HG13 ' A' ' 30' ' ' VAL . 2.8 ptm180 -74.69 -13.6 60.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.905 0.383 . . . . 0.0 111.34 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.52 32.89 14.68 Favored Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.403 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.777 HG13 ' HG3' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -142.37 112.54 2.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -178.895 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.838 ' HA ' HD11 ' A' ' 37' ' ' ILE . 0.2 OUTLIER -169.12 15.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -179.282 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -125.06 13.68 8.41 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 -174.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.633 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 49.4 m -122.32 124.47 43.8 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.6 mm? -68.91 -38.62 79.69 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.45 -15.64 60.41 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.414 0.626 . . . . 0.0 109.79 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.633 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 37.8 m -84.06 -48.2 10.15 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.943 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.838 HD11 ' HA ' ' A' ' 31' ' ' ASN . 33.7 mm -59.44 -29.74 42.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.51 -43.31 93.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.782 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 14.5 mmmm -83.71 -34.62 24.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.121 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' HD11 ' A' ' 25' ' ' LEU . 11.2 mm-40 -66.39 -33.88 76.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.3 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.76 -34.09 72.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.114 0.483 . . . . 0.0 109.845 171.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.643 HG12 ' HA ' ' A' ' 62' ' ' THR . 80.9 mt -73.11 -51.6 25.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.232 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.9 t -58.78 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.755 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -65.57 -35.57 81.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.017 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 25.9 t -65.07 -33.34 75.8 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.87 177.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.6 tp -87.07 -15.93 37.09 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.187 0.518 . . . . 0.0 111.05 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -90.48 -14.96 31.71 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.937 -175.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -92.37 -169.91 2.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.548 -173.582 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -94.82 173.62 7.51 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.875 177.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.44 -49.17 33.13 Favored Glycine 0 C--N 1.33 0.242 0 O-C-N 123.821 0.701 . . . . 0.0 114.651 -168.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.783 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 12.6 mptt -61.98 -41.29 97.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.216 0.508 . . . . 0.0 111.127 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 13.8 mm-40 -68.58 -40.47 80.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.195 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -59.28 -36.52 75.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.48 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -77.62 -37.85 49.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.647 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.767 HD22 HG12 ' A' ' 13' ' ' VAL . 53.3 tp -63.48 -29.5 70.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.154 -174.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 13.4 p -63.59 -27.33 69.17 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.771 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.71 -30.65 71.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 0.0 110.186 175.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 97' ' ' ILE . 85.1 m-85 -86.48 -22.59 26.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.683 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' HG21 ' A' ' 73' ' ' VAL . 87.3 mt -106.19 29.63 6.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.861 0.362 . . . . 0.0 111.772 -175.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.582 ' O ' ' HG ' ' A' ' 70' ' ' LEU . . . 63.15 62.97 4.92 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 113.504 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.6 177.62 7.68 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.643 ' HA ' HG12 ' A' ' 42' ' ' ILE . 42.9 p 62.9 148.12 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.492 1.117 . . . . 0.0 112.31 -179.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -84.68 56.43 3.86 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.624 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -163.19 -35.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.165 -175.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.78 -170.42 2.98 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.29 101.85 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.882 0.739 . . . . 0.0 111.056 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -15.42 41.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.262 -169.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -79.35 -46.38 17.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.8 pt -69.8 -14.27 18.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.613 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.2 tt -55.64 -42.8 75.51 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.766 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.608 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 10.8 p -74.23 -28.16 61.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.92 -22.75 62.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.443 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 59' ' ' LEU . 61.7 t -88.07 -55.31 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.044 172.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.479 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 10.6 p -56.06 -43.45 77.92 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 34' ' ' LEU . 11.5 mpt_? -62.36 -53.02 61.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.35 -177.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 53.2 Cg_exo -57.94 -38.81 90.79 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.742 1.628 . . . . 0.0 112.803 172.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.5 mmt -58.75 -25.12 62.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.637 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.2 t -63.12 -14.03 43.63 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.574 HG22 ' H ' ' A' ' 80' ' ' HIS . 9.7 p -149.79 175.01 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.574 ' H ' HG22 ' A' ' 79' ' ' VAL . 28.1 m80 -72.62 109.04 5.98 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.783 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 23.7 mmm -125.56 166.9 18.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 121.936 0.874 . . . . 0.0 113.179 -170.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.783 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.1 Cg_exo -39.89 2.95 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.951 1 C-N-CA 128.211 5.94 . . . . 0.0 118.339 169.525 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.555 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -39.17 -32.78 0.11 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -164.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.601 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.3 OUTLIER -61.87 -35.32 77.95 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.388 0.995 . . . . 0.0 110.397 176.668 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 16.1 ptpt -86.43 -19.59 29.41 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 1.014 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 37.7 mt -61.63 -41.72 91.4 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.327 -179.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.524 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 49.1 t -70.36 -22.32 62.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.322 0.582 . . . . 0.0 110.641 176.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.54 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 17.4 mm-40 -70.13 -26.25 63.86 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 1.014 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 8.5 mtmp? -81.53 -28.99 33.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.494 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.567 ' HA ' HD13 ' A' ' 93' ' ' LEU . 2.8 mm? -63.57 -29.2 70.49 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.474 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 45.2 mttp -55.24 -26.76 41.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.06 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -75.5 -15.55 60.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.567 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.5 mp -91.2 -52.98 4.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.452 176.047 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.563 ' HB3' HG13 ' A' ' 97' ' ' ILE . 25.6 t70 -158.65 138.7 12.19 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.834 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 43.0 m -85.22 -24.63 27.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.191 -176.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.436 ' HB3' ' OD2' ' A' ' 94' ' ' ASP . 59.2 tt0 -70.37 -22.23 62.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.299 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 94' ' ' ASP . 36.3 mt -52.69 -45.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.717 0.77 . . . . 0.0 109.733 172.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 -47.27 9.09 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.972 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.22 42.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.476 HD23 HG11 ' A' ' 13' ' ' VAL . 18.4 tp -70.35 -53.91 14.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.836 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.487 ' HB3' ' HA ' ' A' ' 104' ' ' LYS . 72.6 mmtt 69.4 121.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.602 0.715 . . . . 0.0 112.003 176.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.783 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.4 m-85 -67.07 -68.26 0.39 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.023 178.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -116.63 22.03 13.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.036 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 101' ' ' LYS . 61.8 mmtt 66.7 6.94 4.82 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.105 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 8.8 m . . . . . 0 N--CA 1.439 -1.009 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.95 -166.006 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.976 0.417 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.502 ' HG2' ' CZ ' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -90.63 -175.15 4.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.293 172.287 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.452 ' HB3' HD21 ' A' ' 19' ' ' ASN . . . -129.54 56.32 1.72 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.811 0.339 . . . . 0.0 111.257 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.7 -99.9 1.91 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.432 172.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -81.75 12.14 43.11 Favored Glycine 0 N--CA 1.455 -0.094 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.789 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.603 ' HB3' ' HG3' ' A' ' 15' ' ' LYS . 12.2 mpt_? 55.62 72.84 0.95 Allowed Pre-proline 0 C--N 1.331 -0.229 0 C-N-CA 122.873 0.469 . . . . 0.0 112.231 178.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . 13.9 Cg_exo -70.16 52.62 1.14 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.562 2.175 . . . . 0.0 111.622 172.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -98.62 -30.14 7.01 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.577 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . 164.38 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 123.907 0.883 . . . . 0.0 109.855 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -110.86 -19.05 12.95 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.95 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 62.3 m -71.28 -0.99 11.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.902 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.858 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 36.5 tt0 72.85 -65.84 0.34 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 114.892 -1.049 . . . . 0.0 113.626 166.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.905 HG12 HD22 ' A' ' 55' ' ' LEU . 57.6 t -62.61 -42.67 96.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.031 -176.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 29.9 p -74.74 -18.56 60.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.384 175.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 9.6 ptmt -72.1 -38.16 69.4 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -67.74 -51.82 44.79 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.561 175.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -58.09 -54.94 41.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.552 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.9 mt -65.83 -32.75 74.45 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 121.33 -0.148 . . . . 0.0 111.208 -175.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 6' ' ' ARG . 3.0 t-20 -71.58 -53.95 12.05 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.069 -0.253 . . . . 0.0 110.909 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 68.9 mtp180 -53.16 -51.0 63.42 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.047 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.77 -50.61 72.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.789 -179.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.653 ' O ' HG12 ' A' ' 26' ' ' ILE . 26.3 t80 -54.45 -55.63 26.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.867 -178.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 23' ' ' LYS . 20.2 mmtt -69.9 -38.28 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -175.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.7 t -64.31 -27.87 69.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 0.0 110.46 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.82 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 1.4 tp -82.08 -36.31 27.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.31 -176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 22' ' ' TYR . 44.6 mm -65.41 -49.1 80.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.141 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.0 -42.05 90.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.673 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.539 ' HB2' HG12 ' A' ' 30' ' ' VAL . 81.5 mtm180 -77.34 -12.52 59.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.813 0.34 . . . . 0.0 111.729 -177.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.48 39.61 56.21 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.579 HG13 ' HA ' ' A' ' 25' ' ' LEU . 2.2 p -126.09 27.73 2.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 122.921 1.343 . . . . 0.0 109.444 -170.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.82 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 3.6 t-20 -131.92 99.84 4.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.216 -174.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 3.7 t80 166.13 -28.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.627 1.205 . . . . 0.0 108.507 174.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -82.57 120.85 26.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.219 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -59.29 -38.58 80.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.619 -175.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.52 -25.67 50.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.005 0.431 . . . . 0.0 110.618 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.447 HG21 HG23 ' A' ' 30' ' ' VAL . 29.7 m -77.69 -44.72 27.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.895 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.468 HD11 ' HA ' ' A' ' 78' ' ' SER . 66.0 mt -61.2 -29.78 46.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.228 0.537 . . . . 0.0 109.688 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -63.1 -54.2 41.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.06 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.2 -41.8 99.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.27 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -69.77 -37.56 76.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.816 -176.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.582 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 25.4 mt -57.12 -43.9 82.8 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 172.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.69 -48.48 88.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.453 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.1 m -69.81 -41.67 74.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.772 0.32 . . . . 0.0 111.845 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.509 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 19.2 t80 -67.47 -34.15 76.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.08 0.467 . . . . 0.0 110.349 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 21.2 m -60.97 -29.88 69.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.664 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 tp -88.3 -26.34 22.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.022 0.439 . . . . 0.0 111.273 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -82.22 -19.09 40.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.423 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -74.61 -173.34 1.77 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.871 -178.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.8 173.34 7.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.909 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.82 -44.33 55.23 Favored Glycine 0 CA--C 1.518 0.273 0 O-C-N 123.502 0.501 . . . . 0.0 114.24 -170.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -59.78 -38.58 82.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.208 0.504 . . . . 0.0 110.667 178.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.5 mt-10 -83.28 -37.51 23.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.936 -175.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -58.04 -45.86 86.29 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' ' CD2' ' A' ' 57' ' ' TYR . 40.9 tpt85 -76.43 -30.72 57.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.383 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.905 HD22 HG12 ' A' ' 13' ' ' VAL . 14.9 tp -58.5 -31.0 67.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.002 176.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.667 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 33.9 t -57.36 -30.12 64.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.644 -177.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.422 ' CD2' ' HD2' ' A' ' 54' ' ' ARG . 90.3 m-85 -65.73 -16.72 64.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.971 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.422 ' HB3' HG12 ' A' ' 97' ' ' ILE . 87.5 m-85 -86.28 -48.81 8.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.006 0.432 . . . . 0.0 110.583 175.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 78.6 mt -75.26 -17.35 60.33 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.055 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.516 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 98.92 -108.58 3.61 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -176.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.667 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . 50.57 21.82 0.95 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 172.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -140.48 150.99 44.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.139 -178.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -90.54 47.25 1.41 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -151.41 -52.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.921 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.59 104.0 14.85 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.867 -175.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.725 ' O ' HG22 ' A' ' 69' ' ' ILE . . . 49.42 61.19 3.27 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.895 0.747 . . . . 0.0 110.719 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 70' ' ' LEU . 1.0 OUTLIER -61.04 -18.28 56.93 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -167.637 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 23.3 ttpp -66.49 -27.83 68.09 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.052 -0.405 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 66' ' ' ALA . 20.4 tt -68.77 -21.82 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -61.28 -46.12 91.66 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 174.724 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.1 m -69.0 -30.64 69.08 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 65.4 mm-40 -66.62 -58.08 5.9 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.372 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.608 ' O ' ' HB2' ' A' ' 77' ' ' MET . 61.4 t -60.76 -44.77 98.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.401 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.9 p -52.92 -35.33 58.23 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -176.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HD3' ' O ' ' A' ' 71' ' ' SER . 7.1 mpt_? -63.95 -56.08 27.6 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.487 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.531 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 37.8 Cg_endo -70.63 -26.78 23.12 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 121.212 1.275 . . . . 0.0 112.044 173.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 1.6 tpt -67.0 -19.81 65.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 0.0 110.677 -179.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.468 ' HA ' HD11 ' A' ' 37' ' ' ILE . 67.6 m -73.04 -12.85 61.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.704 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.428 HG13 ' HG2' ' A' ' 81' ' ' MET . 2.8 p -130.92 148.87 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.5 m170 -55.42 109.7 0.59 Allowed 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 26.9 mmm -132.6 164.05 46.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -165.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.778 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 32.9 Cg_exo -40.37 3.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.768 1 C-N-CA 128.415 6.076 . . . . 0.0 118.333 169.36 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.541 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.97 -32.83 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.982 2.215 . . . . 0.0 116.982 -159.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.725 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -60.32 -39.49 87.22 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.933 1.242 . . . . 0.0 110.35 173.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 38.2 ttpt -80.56 -14.5 58.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.089 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.541 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 47.5 mt -72.02 -42.79 68.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 46.8 t -69.71 -31.11 68.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.201 0.524 . . . . 0.0 109.607 173.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.441 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 12.0 tp10 -57.42 -48.76 78.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.234 172.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 64.7 mttt -64.9 -29.17 70.1 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 177.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.1 mt -65.56 -14.45 61.12 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.082 -178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.551 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 56.8 mtpt -66.4 -20.33 66.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.58 177.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.426 ' HB3' ' NZ ' ' A' ' 92' ' ' LYS . 3.7 mmmp? -73.16 -21.49 60.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.935 176.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.3 -46.84 5.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.925 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -142.51 119.59 11.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.411 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.4 m -86.74 -13.65 44.68 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.621 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -78.43 -24.77 45.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.708 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.422 HG12 ' HB3' ' A' ' 58' ' ' TYR . 65.4 mt -47.08 -43.26 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.353 179.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.95 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 55.7 m -77.1 -15.67 59.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -168.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.84 39.35 3.54 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.658 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.528 ' HB3' HG21 ' A' ' 13' ' ' VAL . 5.6 mp -74.82 -58.61 3.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 168.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt 68.0 132.95 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.834 0.826 . . . . 0.0 112.815 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.625 ' CE2' ' HA ' ' A' ' 13' ' ' VAL . 93.2 m-85 -84.11 -56.07 3.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.853 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -117.17 19.44 14.19 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.623 -0.431 . . . . 0.0 112.104 -171.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -81.87 -50.49 9.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 168.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.251 1.177 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.015 175.46 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 9.8 pt20 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 1' ' ' GLN . 39.7 tt0 173.38 157.0 0.12 Allowed 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -171.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.08 93.54 2.41 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.236 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.56 -50.31 68.27 Favored Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -92.47 169.59 31.76 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 168.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 10.2 mmt180 -133.54 63.92 66.39 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 117.814 0.807 . . . . 0.0 111.373 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 91.0 Cg_endo -100.42 50.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.19 0 C-N-CA 123.294 2.663 . . . . 0.0 111.413 177.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.607 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -71.26 -34.08 64.36 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.527 -169.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.832 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.52 -90.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.626 0.251 . . . . 0.0 111.16 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -159.32 -73.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.062 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 98' ' ' CYS . 0.6 OUTLIER -84.09 73.28 10.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.657 0.742 . . . . 0.0 112.536 -176.118 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 42.2 mt-10 52.18 -104.17 0.18 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 167.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.523 HG12 HD12 ' A' ' 55' ' ' LEU . 19.0 t -50.17 -51.16 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -161.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.6 t -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.332 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.832 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 7.6 ptpt -72.05 -38.83 69.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 109.913 -178.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.59 -43.51 98.73 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.506 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -62.62 -55.86 23.18 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.366 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.4 mt -62.65 -41.69 99.19 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 121.099 -0.241 . . . . 0.0 111.194 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 2.8 t-20 -62.27 -55.75 25.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.508 0.195 . . . . 0.0 111.399 -176.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.19 -39.12 91.64 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE1' ' HA ' ' A' ' 41' ' ' LEU . 81.3 t80 -65.91 -49.73 66.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.242 0.544 . . . . 0.0 110.648 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.696 ' HE2' ' H ' ' A' ' 81' ' ' MET . 67.7 t80 -54.39 -37.18 64.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.629 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.7 mmmt -81.06 -47.05 14.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.326 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -56.11 -33.57 65.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.194 -176.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.766 ' HG ' HG23 ' A' ' 30' ' ' VAL . 2.4 tp -73.65 -33.2 64.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.941 0.4 . . . . 0.0 110.531 -176.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 22' ' ' TYR . 25.1 mm -79.99 -34.99 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.5 -43.3 99.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.685 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -71.72 -21.09 61.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.91 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.28 22.72 43.31 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.993 -0.623 . . . . 0.0 111.814 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.766 HG23 ' HG ' ' A' ' 25' ' ' LEU . 32.6 m -105.48 -136.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 CA-C-N 115.095 -0.552 . . . . 0.0 109.802 -177.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.454 ' N ' HG23 ' A' ' 30' ' ' VAL . 66.3 t30 74.1 -177.89 0.17 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.374 0.67 . . . . 0.0 111.444 175.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.408 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 53.1 t80 73.87 -57.12 0.63 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.136 0.974 . . . . 0.0 111.453 -177.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.583 ' O ' HG13 ' A' ' 37' ' ' ILE . 4.1 m -67.39 114.32 5.98 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -55.03 -41.12 70.97 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.801 -177.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -39.14 92.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.477 0.656 . . . . 0.0 110.144 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 22.1 m -74.1 -41.67 61.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.5 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.587 HG22 HG22 ' A' ' 74' ' ' THR . 61.5 mt -59.39 -33.96 52.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.83 -54.05 26.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.892 177.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -56.92 -52.88 63.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.152 -177.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.578 ' OE2' HG21 ' A' ' 30' ' ' VAL . 11.3 mt-10 -74.62 -20.76 59.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.805 -175.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.629 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 42.5 tp -63.4 -45.56 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.51 -46.9 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.317 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.483 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 58.4 m -55.34 -52.1 64.6 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.461 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -63.82 -44.92 91.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.373 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 8.1 t -64.42 -43.68 93.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.4 mm? -78.44 -14.31 59.43 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.002 0.429 . . . . 0.0 111.003 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.4 -23.03 40.68 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.572 177.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -74.3 -165.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.797 179.033 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -93.91 170.31 9.65 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.385 -0.197 . . . . 0.0 111.268 -176.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.78 -45.04 61.09 Favored Glycine 0 C--N 1.329 0.188 0 CA-C-N 115.889 -0.596 . . . . 0.0 114.565 -168.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tppt? -59.07 -41.68 88.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.444 0.64 . . . . 0.0 110.328 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.533 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 18.1 mt-10 -77.41 -34.7 54.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.263 -177.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -62.29 -50.41 71.77 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 13.7 tpt180 -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.102 -0.953 . . . . 0.0 111.18 -177.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -52.02 -37.96 55.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.84 -179.592 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.788 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 82.0 m -72.19 -14.48 61.81 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.426 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 63.2 m-85 -68.56 -34.34 75.65 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.581 ' HB3' HG12 ' A' ' 97' ' ' ILE . 28.2 m-85 -87.27 -42.3 13.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.422 176.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' A' ' 55' ' ' LEU . 31.0 mt -60.95 -34.43 74.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.365 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.652 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 103.65 -7.01 49.45 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.956 -178.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -76.23 48.2 0.5 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.365 0.602 . . . . 0.0 111.488 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.5 m -155.2 120.67 4.99 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -80.97 41.21 0.57 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.324 0.583 . . . . 0.0 111.091 -175.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -130.43 -6.76 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.268 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.84 -152.43 0.5 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.674 -175.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.41 125.17 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.947 0.403 . . . . 0.0 110.321 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.0 p -80.35 -33.54 37.26 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.066 -172.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.515 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 52.8 tttp -66.9 -42.74 84.97 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.368 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.652 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.0 tt -64.68 -28.39 44.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.814 0.34 . . . . 0.0 110.937 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tt -61.06 -47.8 84.67 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 172.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.525 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.7 m -64.51 -34.67 78.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.463 177.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 51.7 mm-40 -62.77 -23.87 67.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.259 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' MET . 59.8 t -87.66 -56.07 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.205 0.526 . . . . 0.0 110.713 172.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.587 HG22 HG22 ' A' ' 37' ' ' ILE . 20.7 p -59.22 -37.04 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -172.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.525 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.6 mpt_? -64.53 -54.82 34.17 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.581 -176.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -62.09 -35.16 77.45 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.224 1.283 . . . . 0.0 111.462 173.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.521 ' HB3' HG21 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -62.5 -13.31 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.898 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.498 ' HA ' HD11 ' A' ' 37' ' ' ILE . 29.2 t -62.14 -26.33 68.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.212 0.53 . . . . 0.0 110.476 177.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 8.4 p -123.57 152.9 28.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -58.11 120.34 8.43 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 1.4 mmt -125.5 149.85 66.05 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -161.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 66.7 Cg_exo -43.88 2.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.479 0.668 1 C-N-CA 127.27 5.314 . . . . 0.0 116.406 165.04 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.514 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.98 -22.5 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -158.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.607 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -48.13 -40.6 24.14 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 118.538 0.608 . . . . 0.0 110.223 164.903 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -87.22 -23.43 24.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 60.3 mt -64.36 -33.9 65.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.96 0.409 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 49.0 t -64.71 -30.16 71.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.4 0.619 . . . . 0.0 110.528 176.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -73.26 -32.9 64.96 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.927 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.64 -40.54 92.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.38 0.609 . . . . 0.0 109.7 173.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.581 ' HA ' HD13 ' A' ' 93' ' ' LEU . 94.4 mt -69.14 -17.67 63.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.384 -178.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.56 ' HD3' ' SG ' ' A' ' 98' ' ' CYS . 13.9 mmmm -65.26 -21.9 66.79 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.953 0.406 . . . . 0.0 110.664 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -77.45 -27.31 52.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.171 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.581 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.2 mp -83.43 -45.8 13.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.838 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.647 ' HB3' HG13 ' A' ' 97' ' ' ILE . 10.7 t70 -154.09 129.82 10.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.55 177.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.3 t -82.47 -35.61 27.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.019 -176.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.496 ' HA ' ' HB2' ' A' ' 99' ' ' GLU . 27.2 tt0 -69.94 -12.9 61.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.253 -174.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.647 HG13 ' HB3' ' A' ' 94' ' ' ASP . 38.2 mt -43.76 -55.17 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.601 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.58 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 26.6 p -91.94 -19.13 22.76 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.669 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 96' ' ' GLN . 42.8 mt-10 -88.71 17.32 5.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.372 -175.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.58 HD12 ' HG ' ' A' ' 55' ' ' LEU . 74.7 mt -62.26 -42.37 99.27 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 99' ' ' GLU . 56.4 mmtt 68.76 141.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.084 0.865 . . . . 0.0 111.605 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -76.61 70.76 3.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.959 176.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 68.79 105.28 0.05 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.29 -177.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -82.67 77.11 9.47 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.254 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.842 -179.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.451 ' HB3' ' HG2' ' A' ' 20' ' ' ARG . 79.0 mt-30 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.776 ' HG2' ' H ' ' A' ' 4' ' ' GLY . 35.2 tt0 72.99 150.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.957 0.786 . . . . 0.0 111.099 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.733 ' HB3' ' HG2' ' A' ' 7' ' ' PRO . . . -114.44 4.75 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.181 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.776 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . 112.27 92.22 2.04 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.979 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.94 19.9 18.08 Favored Glycine 0 N--CA 1.454 -0.124 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.377 177.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.426 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 18.3 mmm180 53.29 59.44 13.13 Favored Pre-proline 0 N--CA 1.468 0.427 0 C-N-CA 122.871 0.469 . . . . 0.0 110.862 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.733 ' HG2' ' HB3' ' A' ' 3' ' ' ALA . 2.0 Cg_endo -84.93 55.65 4.34 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.063 2.509 . . . . 0.0 111.351 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.929 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -90.46 -35.5 7.39 Favored Glycine 0 N--CA 1.441 -1.022 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.456 -173.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 173.26 -149.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -123.39 -24.44 4.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.483 0.658 . . . . 0.0 109.81 178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.65 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 21.2 m -76.55 1.02 17.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.832 -175.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' CA ' ' HB3' ' A' ' 15' ' ' LYS . 26.4 tp10 69.55 -74.3 0.08 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.942 171.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.684 ' HB ' ' O ' ' A' ' 101' ' ' LYS . 6.6 p -57.83 -46.77 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-O 121.639 0.733 . . . . 0.0 109.727 178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' HD21 ' A' ' 55' ' ' LEU . 8.4 t -68.45 -31.67 71.14 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.302 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.593 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 9.9 ttmt -59.24 -53.25 60.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.332 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.602 ' HG3' ' OH ' ' A' ' 102' ' ' TYR . 22.4 mm-40 -55.21 -49.98 70.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.057 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -62.02 -55.04 33.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.576 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 85.7 mt -56.7 -53.84 53.1 Favored 'General case' 0 C--O 1.223 -0.295 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -173.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.929 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.3 t-20 -67.44 -40.09 85.41 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.397 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.586 HH22 HG22 ' A' ' 48' ' ' THR . 35.6 mtp180 -65.03 -43.34 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.588 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.529 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 55.0 t80 -64.37 -47.27 79.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.3 0.572 . . . . 0.0 109.829 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -51.57 -42.17 61.67 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.648 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.5 mmmt -84.09 -37.76 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.508 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -60.5 -32.27 71.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.156 -178.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 22.9 mt -70.56 -27.92 64.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.022 0.439 . . . . 0.0 110.77 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 27.9 mm -80.18 -48.68 19.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.38 -44.91 95.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.452 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.434 ' HB2' HG12 ' A' ' 30' ' ' VAL . 62.8 mtp180 -79.43 -13.79 59.36 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.09 28.76 59.81 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.046 178.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.48 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.4 p -124.23 92.97 2.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.171 0.51 . . . . 0.0 109.858 -175.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -158.87 178.62 9.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.855 -174.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 78' ' ' SER . 25.6 t80 75.91 -55.39 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.462 1.105 . . . . 0.0 112.301 175.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.725 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 8.6 m -60.79 118.39 6.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.083 0.468 . . . . 0.0 110.91 -177.202 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.27 -41.72 89.52 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.578 -174.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.61 -26.14 60.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 18.7 m -74.77 -45.49 43.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.302 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.616 HG21 ' HA ' ' A' ' 74' ' ' THR . 21.9 mm -58.45 -34.29 50.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.41 -52.18 59.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.75 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.746 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -57.42 -37.31 72.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.775 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.48 ' HG3' HG21 ' A' ' 30' ' ' VAL . 59.1 mm-40 -85.13 -28.63 25.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.849 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.44 -42.5 92.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.1 mt -61.48 -52.19 64.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.843 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -65.04 -44.71 88.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.955 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -70.84 -27.02 63.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.47 . . . . 0.0 110.287 -176.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.5 t -62.95 -25.66 68.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.981 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -85.83 -37.5 19.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.47 56.41 3.57 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.563 0.697 . . . . 0.0 110.365 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.788 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -153.99 -173.4 4.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.487 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -97.35 171.89 8.12 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.416 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.21 29.9 Favored Glycine 0 C--N 1.331 0.252 0 O-C-N 123.603 0.565 . . . . 0.0 114.039 -173.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.76 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 0.6 OUTLIER -56.98 -43.87 82.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.951 0.405 . . . . 0.0 110.888 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.788 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 12.5 mt-10 -82.64 -32.84 28.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.97 -176.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -61.04 -37.1 81.4 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 18.7 tpt180 -82.07 -32.61 30.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.071 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.834 ' HA ' ' CZ ' ' A' ' 58' ' ' TYR . 34.9 tp -50.08 -46.94 53.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.236 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.446 ' SG ' HG23 ' A' ' 62' ' ' THR . 1.6 p -63.72 -17.78 63.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.722 -174.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.8 m-85 -62.75 -51.0 68.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.834 ' CZ ' ' HA ' ' A' ' 55' ' ' LEU . 1.8 p90 -87.32 -17.52 32.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.23 -175.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.2 mt -78.08 -31.1 49.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.443 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.27 91.31 2.21 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.872 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -160.06 -53.48 0.05 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.115 0.484 . . . . 0.0 110.044 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.446 HG23 ' SG ' ' A' ' 56' ' ' CYS . 2.9 p -82.3 139.35 34.22 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.58 178.219 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -81.81 6.35 15.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -90.17 5.8 45.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.539 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.54 -152.06 0.4 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.888 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.26 110.88 2.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.153 0.501 . . . . 0.0 110.908 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.9 p -84.99 -19.01 32.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.456 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -71.96 -47.33 53.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.232 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.524 HD11 HD22 ' A' ' 90' ' ' LEU . 14.5 tt -65.83 -16.94 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.11 -176.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.3 tt -54.17 -46.32 72.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.329 0.585 . . . . 0.0 109.624 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.415 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 7.1 m -67.89 -25.13 65.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.791 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -73.51 -18.17 61.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 44.5 t -88.54 -47.67 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.166 0.507 . . . . 0.0 110.848 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.616 ' HA ' HG21 ' A' ' 37' ' ' ILE . 55.9 p -59.06 -39.6 82.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.453 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.3 OUTLIER -61.31 -55.52 42.77 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.827 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.636 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 11.8 Cg_endo -61.05 -42.09 39.05 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 121.223 1.282 . . . . 0.0 112.742 177.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mmt -64.28 -20.69 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.676 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 33.6 t -60.36 -27.26 67.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.485 178.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 80' ' ' HIS . 4.7 p -127.5 -87.32 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.001 178.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.893 ' H ' HG13 ' A' ' 79' ' ' VAL . 91.1 m-70 -150.69 -80.06 0.12 Allowed 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 177.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 35.1 mtp 68.81 167.4 0.12 Allowed Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 168.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.574 ' HB2' HG13 ' A' ' 86' ' ' ILE . 18.4 Cg_exo -40.65 -0.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.218 1 C-N-CA 127.553 5.502 . . . . 0.0 118.977 177.87 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.595 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -34.73 -46.23 0.28 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -156.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.695 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -52.13 -53.71 39.38 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.327 1.06 . . . . 0.0 109.644 174.314 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 34.2 tttp -76.29 -18.02 59.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.046 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.993 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 20.1 mt -60.67 -40.57 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 O-C-N 122.136 -0.352 . . . . 0.0 110.255 175.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 14.8 t -67.04 -19.98 65.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.172 0.51 . . . . 0.0 110.698 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 41.5 mt-10 -78.65 -40.23 34.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.448 0.642 . . . . 0.0 109.836 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.993 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.2 mtmp? -67.83 -30.78 70.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.115 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 69' ' ' ILE . 18.6 mt -66.81 -17.2 64.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.571 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.615 ' HG2' ' HB2' ' A' ' 98' ' ' CYS . 45.1 mtpt -68.71 -14.31 62.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.319 -177.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 89' ' ' LYS . 34.0 mtmm -62.04 -39.27 91.77 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.014 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 94' ' ' ASP . 5.9 mp -91.01 71.73 6.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.58 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 27.9 m-20 72.06 105.21 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.012 -175.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.2 m -70.42 -13.54 62.17 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.029 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -49.83 -34.41 19.71 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.926 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.581 HG23 ' HD2' ' A' ' 58' ' ' TYR . 73.3 mt -52.66 -31.14 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.536 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.65 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 5.0 t -86.54 -18.69 30.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.631 -173.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -111.12 52.38 0.74 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.439 0.638 . . . . 0.0 111.322 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.567 HD22 ' OH ' ' A' ' 58' ' ' TYR . 1.5 mp -103.02 -45.05 5.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.889 169.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.684 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 29.6 mmtp 64.33 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.248 -178.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.76 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.4 m-85 -164.22 -97.59 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 170.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -99.48 -52.68 3.42 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 161.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.549 ' HD3' ' HA ' ' A' ' 104' ' ' LYS . 2.0 mmtm 179.72 -42.46 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.951 -1.477 . . . . 0.0 109.022 169.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 105' ' ' THR . 6.0 t . . . . . 0 C--O 1.248 1.022 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.863 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.618 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 9.2 mm100 . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 110.67 -0.122 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.675 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 11.3 pt-20 55.82 -176.3 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.439 1.095 . . . . 0.0 111.945 174.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.17 -0.85 15.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.071 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.464 ' H ' ' HG3' ' A' ' 2' ' ' GLU . . . -64.64 103.5 0.77 Allowed Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.523 176.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.23 -15.9 9.29 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.877 -177.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.452 ' HB2' ' CD ' ' A' ' 7' ' ' PRO . 28.5 ptt180 -138.64 168.32 16.23 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -178.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.452 ' CD ' ' HB2' ' A' ' 6' ' ' ARG . 11.9 Cg_endo -92.07 91.23 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.857 2.372 . . . . 0.0 111.117 -171.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.901 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -72.33 -37.95 58.79 Favored Glycine 0 N--CA 1.439 -1.112 0 C-N-CA 119.601 -1.285 . . . . 0.0 111.936 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.991 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -173.7 -83.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.413 -176.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -162.67 -67.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.816 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' H ' ' A' ' 12' ' ' GLU . 5.4 m -57.52 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.679 0.612 . . . . 0.0 112.084 -175.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 4.4 tp10 -170.35 -75.98 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.495 0 O-C-N 122.063 -0.398 . . . . 0.0 111.055 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' ' 100' ' ' LEU . 38.9 t -55.6 -43.06 71.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.712 0.767 . . . . 0.0 109.968 179.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' HD21 ' A' ' 55' ' ' LEU . 37.1 t -61.2 -36.16 79.12 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.172 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.64 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 3.2 ptpp? -77.91 -32.84 51.96 Favored 'General case' 0 N--CA 1.458 -0.052 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.11 -177.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 56.9 mm-40 -57.84 -52.5 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.523 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.78 -55.16 32.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.336 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 9' ' ' ALA . 82.9 mt -61.37 -46.08 91.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 121.335 -0.146 . . . . 0.0 111.207 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.901 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.4 t-20 -62.06 -52.95 61.86 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.987 0.179 . . . . 0.0 111.327 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.675 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 51.1 mtm-85 -65.4 -41.86 93.21 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.562 -177.265 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -59.05 -49.13 79.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.831 0.824 . . . . 0.0 109.584 178.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.537 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 70.0 t80 -53.73 -55.35 27.04 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.256 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -67.39 -34.02 76.41 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.7 m -62.3 -33.9 75.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.933 0.397 . . . . 0.0 111.271 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.6 mp -77.46 -39.83 45.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.35 -45.84 92.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.246 0.546 . . . . 0.0 109.772 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.71 -51.53 68.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.569 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.735 ' HB2' HG12 ' A' ' 30' ' ' VAL . 90.2 mtm-85 -78.25 -13.47 59.84 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.8 25.87 68.51 Favored Glycine 0 CA--C 1.509 -0.322 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 -176.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.744 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 4.0 p -109.28 57.91 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 122.425 1.107 . . . . 0.0 109.683 -173.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.533 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 66.6 t30 -140.7 -179.09 5.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.06 -172.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.8 t80 73.09 -55.84 0.67 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.254 1.021 . . . . 0.0 111.329 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.484 ' O ' HG13 ' A' ' 37' ' ' ILE . 22.3 m -60.52 109.75 1.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.834 0.349 . . . . 0.0 110.644 178.232 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.3 mm? -59.66 -38.88 82.67 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.858 -175.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -61.15 -38.39 86.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.311 0.577 . . . . 0.0 110.626 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 m -76.43 -41.65 46.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.196 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 33' ' ' SER . 61.1 mt -60.44 -32.3 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.13 -50.56 69.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.509 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.1 tptt -62.95 -35.2 79.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.844 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -74.2 -36.74 64.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.67 -178.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.446 HD12 HG23 ' A' ' 74' ' ' THR . 17.1 mt -58.36 -38.78 77.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 172.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.773 HG12 ' HA ' ' A' ' 62' ' ' THR . 96.1 mt -65.43 -49.3 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.905 176.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -63.64 -55.36 24.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.031 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -61.68 -29.45 70.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.666 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.553 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.5 t -54.23 -50.77 66.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 175.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.1 mt -88.42 -14.57 37.68 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.812 0.339 . . . . 0.0 111.833 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -94.93 -1.74 51.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 111.385 -174.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.796 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -85.58 -161.71 0.64 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.856 177.025 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -93.87 169.54 10.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.627 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -46.73 -52.24 11.68 Favored Glycine 0 N--CA 1.453 -0.176 0 O-C-N 123.769 0.668 . . . . 0.0 114.26 -170.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -63.72 -39.93 95.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.244 0.522 . . . . 0.0 110.821 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.796 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 50.3 mt-10 -72.21 -31.19 65.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.515 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 74.1 m-20 -66.79 -21.05 66.05 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.667 175.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 7.0 mmm180 -86.01 -44.6 12.18 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.585 HD11 HG23 ' A' ' 97' ' ' ILE . 27.8 tp -59.58 -24.87 64.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.427 -1.26 . . . . 0.0 112.598 -172.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 7.6 p -63.84 -34.85 78.85 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.536 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -74.84 -17.09 60.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.147 0.498 . . . . 0.0 110.003 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.579 ' HB3' HG12 ' A' ' 97' ' ' ILE . 63.0 m-85 -85.41 -51.59 6.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.759 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.29 -46.65 89.42 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.962 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.553 ' O ' ' HA ' ' A' ' 70' ' ' LEU . . . 131.9 59.78 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.968 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -128.85 169.53 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.773 ' HA ' HG12 ' A' ' 42' ' ' ILE . 16.9 p 66.21 142.66 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.295 1.038 . . . . 0.0 111.65 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.448 ' HB3' ' NZ ' ' A' ' 63' ' ' LYS . 9.3 mtpm? -90.73 19.05 5.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -93.12 -27.81 16.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.814 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.81 -167.28 1.39 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.273 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.73 119.93 5.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.055 0.455 . . . . 0.0 110.991 178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.26 -16.16 44.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.667 -176.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 27.5 ttpp -62.73 -51.94 65.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.35 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 72' ' ' GLU . 8.5 tp -65.88 -25.73 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.553 ' HA ' ' O ' ' A' ' 60' ' ' GLY . 2.8 tt -61.4 -45.08 95.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.502 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 45.3 m -66.68 -35.14 79.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.304 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.476 ' HB2' HD12 ' A' ' 69' ' ' ILE . 42.4 mt-10 -68.86 -23.42 64.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.756 -177.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.482 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 91.6 t -88.01 -48.53 15.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.774 0.321 . . . . 0.0 111.371 174.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.446 HG23 HD12 ' A' ' 41' ' ' LEU . 7.9 p -54.02 -47.27 71.7 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -176.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.1 mpt_? -58.09 -53.29 67.45 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.745 -177.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.551 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 52.7 Cg_exo -56.74 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.78 1.654 . . . . 0.0 113.1 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.5 mmt -62.69 -14.05 39.47 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.823 0.344 . . . . 0.0 111.749 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 31.5 t -74.27 -14.87 60.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.262 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.647 HG22 ' H ' ' A' ' 80' ' ' HIS . 4.4 p -136.18 -178.15 2.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.647 ' H ' HG22 ' A' ' 79' ' ' VAL . 60.0 t-80 -56.09 -64.29 0.91 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 117.869 0.304 . . . . 0.0 110.336 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER 67.04 146.39 0.11 Allowed Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 51.7 Cg_exo -41.87 0.99 0.0 OUTLIER 'Trans proline' 0 C--O 1.21 -0.878 1 C-N-CA 126.838 5.025 . . . . 0.0 117.723 167.039 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.567 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.1 -34.53 0.06 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -159.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.991 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 1.1 mpp? -55.88 -56.64 18.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.872 0.844 . . . . 0.0 109.559 171.128 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 82' ' ' PRO . 44.4 mttm -68.54 -19.87 64.52 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.616 -1.174 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 83' ' ' ALA . 24.7 mt -60.87 -29.63 45.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.046 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.546 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 46.0 t -72.04 -34.34 68.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.428 0.632 . . . . 0.0 110.026 176.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.596 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 51.0 mt-10 -69.09 -41.12 77.91 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.681 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -76.11 -28.21 57.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.669 177.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 90' ' ' LEU . 6.9 mt -67.63 -28.15 67.48 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.995 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.596 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 25.7 mtpp -60.75 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.958 176.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -79.15 -13.89 59.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.374 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.2 mp -100.21 -49.57 4.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.647 174.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -142.09 118.78 11.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.906 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.2 p -85.65 -15.11 43.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.798 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -71.13 -29.99 65.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.585 HG23 HD11 ' A' ' 55' ' ' LEU . 95.4 mt -50.87 -40.36 20.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.907 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.426 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 49.6 t -71.36 -52.26 19.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.357 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -97.2 36.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.717 -171.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.597 ' O ' HG21 ' A' ' 13' ' ' VAL . 10.1 tp -84.65 37.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 104' ' ' LYS . 34.0 mmtp -54.02 145.54 16.51 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -172.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -63.0 114.2 3.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.351 -173.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 58.08 35.74 25.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.57 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 101' ' ' LYS . 16.2 tppt? -87.37 72.95 9.7 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 171.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.461 -173.122 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.661 ' HB3' ' HE3' ' A' ' 23' ' ' LYS . 9.6 tp10 -154.95 148.27 25.03 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.392 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 1.049 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . . . -153.46 -153.62 0.48 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.15 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 90.06 101.6 1.13 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.029 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.51 60.02 9.72 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.312 -0.47 . . . . 0.0 112.17 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.41 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 36.3 mmt180 -111.31 154.02 43.83 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 120.68 0.276 . . . . 0.0 111.604 -172.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 84.3 Cg_endo -97.2 64.08 0.11 Allowed 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.916 3.077 . . . . 0.0 111.846 176.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.841 ' H ' ' HD3' ' A' ' 15' ' ' LYS . . . -73.08 -42.64 43.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.107 -176.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.664 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -166.92 -82.68 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.175 0.512 . . . . 0.0 110.963 -172.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -162.16 -62.53 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.319 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 14' ' ' CYS . 4.8 p -77.76 148.13 34.98 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.24 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -58.91 -72.08 0.11 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -172.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 55' ' ' LEU . 6.1 p -51.38 -48.65 33.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -170.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 33.9 t -62.97 -43.18 99.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.924 0.392 . . . . 0.0 110.877 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.841 ' HD3' ' H ' ' A' ' 8' ' ' GLY . 5.2 ptpp? -72.32 -42.13 65.75 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.578 -175.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.61 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 37.0 mm-40 -57.88 -42.73 85.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.535 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -60.0 -51.46 69.57 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.418 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 66.5 mt -60.34 -45.04 94.87 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -50.92 -56.39 12.58 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 123.52 0.512 . . . . 0.0 112.109 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 1.049 ' HD2' ' HB2' ' A' ' 3' ' ' ALA . 0.9 OUTLIER -58.67 -55.24 37.65 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.719 -177.688 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 69.2 t80 -59.08 -48.22 82.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.203 0.525 . . . . 0.0 111.073 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 46.4 t80 -53.3 -48.41 68.41 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.188 -174.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.661 ' HE3' ' HB3' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -85.69 -39.26 17.42 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.504 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -61.96 -32.44 72.87 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.761 0.315 . . . . 0.0 111.356 -178.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 11.5 tp -61.63 -41.94 98.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.307 0.575 . . . . 0.0 109.992 177.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.3 mm -75.26 -38.06 40.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.455 -177.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.14 -45.91 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.596 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -70.08 -23.7 63.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.051 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.36 -5.58 67.84 Favored Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.985 -0.626 . . . . 0.0 111.657 174.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.752 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -86.48 122.41 38.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.048 -0.576 . . . . 0.0 110.201 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -172.03 -177.99 2.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 174.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.465 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 94.9 m-85 71.19 -58.36 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.628 0.771 . . . . 0.0 112.145 178.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 37' ' ' ILE . 12.5 m -64.2 109.07 1.74 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.847 0.356 . . . . 0.0 110.15 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 75' ' ' ARG . 2.6 mm? -59.86 -37.74 80.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.874 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.08 -36.57 82.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.54 0.686 . . . . 0.0 110.045 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.409 HG22 ' CG2' ' A' ' 30' ' ' VAL . 56.6 m -80.09 -38.78 31.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.49 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 33' ' ' SER . 72.1 mt -62.89 -34.75 67.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -72.96 -38.74 66.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.554 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -58.49 -47.73 83.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 175.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.635 ' HG3' HG21 ' A' ' 30' ' ' VAL . 6.7 mm-40 -68.47 -41.42 80.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.526 -176.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.563 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 13.6 mt -55.79 -44.9 78.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 175.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.486 HD13 ' HD3' ' A' ' 63' ' ' LYS . 69.1 mt -62.7 -52.41 60.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.138 178.282 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.1 m -58.94 -47.34 85.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.959 0.409 . . . . 0.0 111.21 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.626 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 30.2 t80 -65.84 -36.25 82.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.746 -176.33 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 6.5 m -69.33 -33.29 72.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.8 mt -85.29 -31.7 22.92 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.373 -0.531 . . . . 0.0 109.938 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.25 70.02 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.72 0.771 . . . . 0.0 110.305 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -159.1 -162.33 1.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.284 177.662 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.64 170.41 9.35 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.286 -0.566 . . . . 0.0 111.145 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.53 -48.37 60.8 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.174 -169.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 11.5 mptt -67.44 -25.74 66.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.448 0.624 . . . . 0.0 111.562 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.45 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 36.5 mt-10 -77.97 -49.38 14.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -58.16 -40.59 81.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.467 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 54' ' ' ARG . 27.2 tpt85 -69.97 -40.35 75.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.214 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 13' ' ' VAL . 43.8 tp -61.25 -34.09 74.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.092 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 64.4 m -68.41 -14.71 63.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -67.7 -29.32 68.55 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -85.54 -39.3 17.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.092 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 66.8 mt -67.33 -31.93 72.54 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.183 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.523 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 109.31 -18.13 30.79 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.873 176.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.533 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -80.58 67.46 6.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.457 0.646 . . . . 0.0 111.393 -177.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 64' ' ' ASP . 25.0 m -155.15 145.7 22.17 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HD3' HD13 ' A' ' 42' ' ' ILE . 31.9 mmmt -76.46 2.97 12.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.261 0.553 . . . . 0.0 110.858 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.533 ' H ' HG22 ' A' ' 62' ' ' THR . 19.9 m-20 -125.27 29.34 6.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.334 171.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.28 170.84 14.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.464 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.51 117.46 18.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.047 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . 39.7 p -73.37 -14.1 61.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.712 -178.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -58.67 -56.33 23.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.62 0.248 . . . . 0.0 110.728 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.523 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.5 tt -69.23 -25.73 30.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.042 0.449 . . . . 0.0 110.377 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 67' ' ' THR . 20.2 tp -60.24 -48.67 80.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.686 174.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 20.8 m -66.05 -29.28 69.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.41 -21.43 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.965 175.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 57.3 t -87.65 -45.0 16.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.809 0.338 . . . . 0.0 111.35 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 28.7 p -57.72 -41.5 81.88 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.579 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.5 mpt_? -59.01 -54.97 51.22 Favored Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.611 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.586 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 50.5 Cg_exo -56.6 -43.13 58.03 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.946 1.764 . . . . 0.0 113.24 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.3 mmt -62.91 -13.75 38.25 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.465 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 40.6 t -69.64 -12.31 61.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.574 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -153.73 -166.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.786 ' H ' HG22 ' A' ' 79' ' ' VAL . 36.9 t60 -60.54 -71.8 0.13 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.886 0.312 . . . . 0.0 110.911 -176.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.762 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 48.8 mmm 64.24 158.0 0.12 Allowed Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 170.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.762 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 52.1 Cg_exo -41.26 1.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.033 1 C-N-CA 128.4 6.067 . . . . 0.0 118.92 172.257 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.639 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.39 -24.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -162.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.652 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -67.96 -58.88 3.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.44 1.018 . . . . 0.0 109.963 173.233 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 64.0 pttt -76.62 -12.14 59.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 -176.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.682 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 16.8 mt -54.52 -35.23 31.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 173.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.481 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 48.8 t -71.34 -29.11 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.166 0.508 . . . . 0.0 110.319 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.654 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 9.0 tp10 -70.8 -38.5 73.34 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.562 0.696 . . . . 0.0 109.144 174.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.09 -20.94 64.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.119 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 69' ' ' ILE . 79.9 mt -78.87 -34.18 45.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.958 173.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.658 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 48.7 mtpt -62.91 -27.3 69.28 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.449 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -60.02 -29.23 68.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.627 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -96.4 -50.88 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.086 0.47 . . . . 0.0 110.258 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.658 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 12.5 t70 -134.57 123.5 23.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.3 m -86.2 -15.28 41.41 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -86.07 -25.66 25.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.171 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 94' ' ' ASP . 14.7 tt -55.47 -31.52 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 121.198 0.523 . . . . 0.0 110.89 178.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 91' ' ' LYS . 6.6 t -75.7 -55.73 5.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.364 0.602 . . . . 0.0 109.509 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -91.07 49.48 1.64 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.225 -176.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.66 ' HB3' HG11 ' A' ' 13' ' ' VAL . 0.6 OUTLIER -76.23 -47.85 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 176.8 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HD2' ' HD3' ' A' ' 104' ' ' LYS . 71.2 mmtt 66.37 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.532 0.733 . . . . 0.0 111.687 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' TYR . . . . . 0.794 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 96.9 m-85 -79.23 41.84 0.47 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.576 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 37.19 48.98 0.82 Allowed 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.881 0.848 . . . . 0.0 110.437 -170.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.732 ' HG3' ' H ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -73.05 -75.58 0.14 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.098 -169.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.732 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 69.2 p . . . . . 0 C--O 1.248 0.977 0 O-C-N 123.991 0.807 . . . . 0.0 111.678 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.414 ' HB3' ' H ' ' A' ' 2' ' ' GLU . 24.2 mt-30 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.667 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 5.6 mp0 -43.26 123.1 2.79 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.673 0.789 . . . . 0.0 111.073 178.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.77 125.39 22.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.095 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 87.35 -79.09 1.8 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.79 -178.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -150.06 -89.22 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.623 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.458 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 27.7 mmt85 -143.51 60.47 8.69 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 122.345 0.258 . . . . 0.0 110.482 176.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 4.8 Cg_endo -87.06 49.36 1.94 Allowed 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.925 2.416 . . . . 0.0 111.325 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -75.87 -26.96 63.54 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.33 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . 177.12 -130.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 123.337 0.655 . . . . 0.0 109.421 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -132.81 -47.2 0.87 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.84 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 48.2 m -77.69 21.25 0.3 Allowed 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.664 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 34.3 tt0 71.4 -67.56 0.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 174.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.745 HG12 HD22 ' A' ' 55' ' ' LEU . 43.8 t -63.28 -55.66 21.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -170.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.782 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.4 p -64.33 -31.1 72.17 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 12.7 ttmt -58.88 -53.9 53.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.5 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 50.2 mm-40 -49.68 -54.67 17.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.655 176.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.32 -54.4 47.39 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.092 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.799 HD11 ' HB2' ' A' ' 87' ' ' CYS . 96.3 mt -57.44 -53.93 52.61 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.704 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -70.61 -43.36 69.47 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.854 -173.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.577 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 46.7 mtp180 -61.33 -41.23 96.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.195 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.466 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 41.1 t80 -59.47 -49.25 78.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.968 0.889 . . . . 0.0 109.631 175.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.588 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 25.7 t80 -58.05 -55.57 33.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.762 -1.563 . . . . 0.0 111.801 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -67.14 -27.72 67.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.714 0.293 . . . . 0.0 110.997 -176.149 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 17.0 t -68.82 -46.13 69.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.632 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -56.85 -52.84 63.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.913 -179.57 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.55 -40.29 88.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.386 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -69.28 -40.24 77.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.033 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -62.55 -31.53 72.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.965 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.3 8.92 40.14 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 174.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.514 HG23 ' N ' ' A' ' 31' ' ' ASN . 5.1 m -89.59 -154.98 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.964 -0.618 . . . . 0.0 109.539 179.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 1.106 ' HA ' HD11 ' A' ' 37' ' ' ILE . 15.8 t30 78.94 91.55 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.747 0.784 . . . . 0.0 112.984 168.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.516 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 17.8 t80 166.45 -30.39 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.682 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG12 ' A' ' 37' ' ' ILE . 13.4 m -87.98 117.24 26.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.692 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.666 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.1 mm? -63.69 -41.04 98.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.307 -172.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.63 -25.89 65.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 89.7 m -78.97 -43.98 23.36 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.86 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 1.106 HD11 ' HA ' ' A' ' 31' ' ' ASN . 47.2 mm -58.61 -31.05 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG3' HD11 ' A' ' 70' ' ' LEU . 28.3 tt0 -57.33 -47.77 80.71 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.563 174.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' HD2' HD12 ' A' ' 42' ' ' ILE . 14.0 mmmm -76.5 -35.2 58.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.921 -178.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' HD11 ' A' ' 25' ' ' LEU . 23.8 mm-40 -62.18 -40.72 96.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.305 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.411 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 19.4 mt -58.9 -33.16 70.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.819 HG12 ' H ' ' A' ' 62' ' ' THR . 76.9 mt -74.64 -46.89 40.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.671 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.9 t -61.89 -47.54 84.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.361 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 32.1 t80 -68.31 -27.88 66.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.364 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 20.3 t -61.08 -28.97 69.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.004 0.43 . . . . 0.0 110.603 174.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -85.98 -42.04 14.35 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -78.17 49.07 0.79 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.03 0.443 . . . . 0.0 111.512 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.816 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -144.34 -173.54 4.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.971 178.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.69 175.85 5.51 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 121.211 -0.196 . . . . 0.0 110.626 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.66 -53.55 12.9 Favored Glycine 0 CA--C 1.522 0.477 0 N-CA-C 114.966 0.747 . . . . 0.0 114.966 -170.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -67.02 -29.56 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 117.62 0.71 . . . . 0.0 110.687 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.816 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 71.6 mt-10 -80.63 -36.25 32.88 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.513 -176.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 -61.08 -53.33 58.41 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 173.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -57.91 -34.64 70.05 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.842 178.061 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.782 HD21 ' HA ' ' A' ' 14' ' ' CYS . 42.7 tp -60.93 -32.69 72.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.43 -175.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 10.3 p -66.94 -21.09 65.99 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.612 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -71.02 -22.96 62.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.127 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.596 ' HB3' HG12 ' A' ' 97' ' ' ILE . 97.3 m-85 -80.47 -35.21 35.16 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.45 -5.53 58.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.844 -179.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 95.17 17.96 35.45 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.992 170.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.402 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -89.31 -179.29 5.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.227 0.513 . . . . 0.0 111.414 -177.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.819 ' H ' HG12 ' A' ' 42' ' ' ILE . 63.2 p 59.6 15.83 4.91 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.531 1.132 . . . . 0.0 113.288 177.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 61.23 -178.94 0.11 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 122.604 0.362 . . . . 0.0 110.903 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.7 t70 71.74 -47.82 0.67 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.435 0.694 . . . . 0.0 110.974 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.27 155.92 27.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.78 112.85 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.889 0.376 . . . . 0.0 111.186 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.0 p -64.9 -14.13 58.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.532 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -49.36 -50.92 37.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 58' ' ' TYR . 18.6 tt -80.67 -24.39 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.699 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.565 HD11 ' HG3' ' A' ' 38' ' ' GLU . 3.4 tm? -57.04 -48.47 78.45 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.607 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 7.8 p -69.56 -35.16 75.14 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.853 177.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.46 -32.62 71.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.784 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . 0.403 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 96.9 t -85.85 -47.08 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.503 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.509 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 7.4 p -55.44 -46.76 76.7 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.666 ' HA ' HD11 ' A' ' 34' ' ' LEU . 3.5 mpt_? -56.38 -56.72 28.75 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.949 -177.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.52 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 72.4 Cg_endo -75.26 -13.77 20.79 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 121.465 1.444 . . . . 0.0 113.836 -177.237 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.2 mmt -74.9 -33.22 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.067 0.46 . . . . 0.0 109.794 172.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.1 m -68.88 -14.5 63.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.561 -173.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.717 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.5 p -139.53 149.53 22.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.588 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 2.0 t60 -58.04 105.32 0.26 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -177.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.717 ' HG3' HG13 ' A' ' 79' ' ' VAL . 45.7 mtp -141.07 174.24 4.09 Favored Pre-proline 0 CA--C 1.541 0.606 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -169.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.64 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.9 Cg_endo -40.83 2.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.114 1 C-N-CA 128.301 6.001 . . . . 0.0 118.97 177.305 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.58 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.74 -44.0 0.32 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -159.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.633 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -59.66 -37.62 79.23 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.033 0.833 . . . . 0.0 110.931 177.331 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 38.0 ttpt -84.81 -17.78 37.03 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.978 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 44.9 mt -61.8 -41.66 91.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.407 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' CYS . . . . . 0.799 ' HB2' HD11 ' A' ' 18' ' ' LEU . 46.6 t -64.65 -27.43 68.92 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.66 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 33.7 tt0 -70.06 -31.34 68.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.381 0.61 . . . . 0.0 109.57 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 53.7 mtmt -78.84 -28.61 44.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.92 174.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 88.0 mt -68.4 -23.85 64.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.298 176.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 50.6 mtpt -62.1 -25.04 67.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -75.25 -34.25 61.37 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.31 -52.14 36.94 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.743 ' HB3' HG13 ' A' ' 97' ' ' ILE . 29.2 t0 -160.7 124.61 3.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.263 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.6 m -74.24 -17.96 60.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.083 -176.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.0 tp60 -76.13 -14.04 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.081 0.467 . . . . 0.0 110.446 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.743 HG13 ' HB3' ' A' ' 94' ' ' ASP . 65.6 mt -67.12 -22.76 29.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.502 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 11' ' ' CYS . 14.2 p -117.52 -38.42 3.31 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.492 -176.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -85.11 56.87 4.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.571 ' HB2' HG21 ' A' ' 13' ' ' VAL . 6.1 mp -85.21 -49.37 8.27 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 174.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.7 mmtt 68.55 130.61 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 O-C-N 124.035 0.834 . . . . 0.0 112.079 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -80.74 68.3 6.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.167 -177.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 72.35 -61.15 0.51 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.416 0.686 . . . . 0.0 111.923 176.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt 57.1 74.07 0.43 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.374 0.607 . . . . 0.0 110.455 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.517 -179.748 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo . . . . . 0 N--CA 1.45 -1.084 0 N-CA-C 110.807 -0.497 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.992 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -70.09 -50.83 26.2 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.544 -172.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.868 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -174.1 -91.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -169.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -134.75 -80.7 0.44 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -71.14 -88.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.38 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 36.9 tt0 -163.64 -77.83 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.553 0 O-C-N 122.315 -0.24 . . . . 0.0 110.563 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.813 HG12 HD22 ' A' ' 55' ' ' LEU . 46.6 t -56.95 -40.36 71.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.685 ' HA ' HD21 ' A' ' 55' ' ' LEU . 35.8 t -59.78 -40.68 89.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.085 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.715 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 15.2 ptpt -75.97 -42.54 48.09 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.624 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 4.7 mm-40 -65.74 -40.9 92.6 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.006 -176.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -62.15 -54.82 35.72 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.62 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 95.5 mt -57.84 -52.74 64.21 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 122.957 0.161 . . . . 0.0 110.772 -177.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.992 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -60.14 -51.3 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 123.125 0.266 . . . . 0.0 111.391 -176.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 20' ' ' ARG . 23.4 mtm180 -67.58 -39.37 84.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.218 -175.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -64.2 -41.76 96.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 122.086 0.946 . . . . 0.0 109.667 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.706 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 14.5 t80 -64.81 -55.7 18.04 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.722 -173.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -76.16 -19.33 58.56 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.998 -176.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 t -64.59 -55.19 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.013 174.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.611 ' HA ' HG13 ' A' ' 30' ' ' VAL . 3.4 mp -59.74 -40.32 87.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.508 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 22' ' ' TYR . 51.4 mm -64.27 -43.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -74.82 -43.74 53.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.461 -177.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.802 ' HB2' HG12 ' A' ' 30' ' ' VAL . 16.2 mtm180 -67.79 -14.38 62.91 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.007 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.19 28.4 66.33 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 28' ' ' ARG . 3.4 p -111.93 51.81 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 CA-C-O 122.761 1.267 . . . . 0.0 109.27 -175.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.458 ' OD1' ' HA ' ' A' ' 78' ' ' SER . 9.2 t-20 -145.09 -167.32 2.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.318 -177.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.44 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 95.8 m-85 68.67 4.59 4.45 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.575 0.75 . . . . 0.0 111.139 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 15.5 m -128.47 107.35 9.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.255 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.064 -173.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -68.72 -32.75 72.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.238 0.542 . . . . 0.0 110.492 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.478 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 55.3 m -73.11 -42.16 63.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' SER . 53.7 mt -59.27 -32.97 49.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.25 0.547 . . . . 0.0 109.543 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -68.43 -44.16 75.56 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 42' ' ' ILE . 47.5 tptt -69.91 -39.06 76.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.682 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.82 -28.31 62.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.904 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.39 -46.87 82.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 168.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 39' ' ' LYS . 82.5 mt -56.06 -52.11 54.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 176.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.5 m -57.14 -55.66 31.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.714 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.88 -39.4 83.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.084 -173.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 56.9 m -62.93 -39.35 94.32 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.35 -29.4 24.51 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.494 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -92.23 58.71 3.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.709 0.766 . . . . 0.0 110.582 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.408 ' C ' HD21 ' A' ' 53' ' ' ASN . 0.2 OUTLIER -153.98 -164.94 1.98 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.295 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -98.11 167.33 10.95 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.398 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.99 -40.14 19.7 Favored Glycine 0 C--N 1.333 0.382 0 O-C-N 123.839 0.712 . . . . 0.0 114.298 -170.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 5.0 mptp? -51.86 -48.48 63.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.919 0.39 . . . . 0.0 111.221 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -82.99 -35.44 25.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.198 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 2.9 m120 -62.59 -33.95 76.0 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.56 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 23.5 tpt180 -83.42 -38.96 21.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.851 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 HG12 ' A' ' 13' ' ' VAL . 19.7 tp -55.34 -39.53 70.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.316 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.76 -23.05 65.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 45.6 m-85 -61.78 -27.15 68.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.614 176.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.475 ' HB3' HG12 ' A' ' 97' ' ' ILE . 62.0 m-85 -86.33 -19.96 29.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.85 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.7 mt -102.2 -22.5 14.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.365 -174.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 124.73 -128.56 6.76 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.205 -0.522 . . . . 0.0 111.822 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.766 ' H ' ' HG ' ' A' ' 70' ' ' LEU . . . 57.24 -167.72 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 112.201 175.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 58.3 p 56.68 11.04 0.8 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.085 0.954 . . . . 0.0 112.922 177.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt 60.8 13.98 4.81 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.879 0.472 . . . . 0.0 111.467 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' HB3' ' H ' ' A' ' 65' ' ' ALA . 3.4 m-20 -151.28 -161.65 1.38 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.088 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . 70.94 -84.03 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 O-C-N 123.817 0.698 . . . . 0.0 111.38 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.02 104.48 5.25 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.92 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.5 p -83.84 -26.31 29.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -77.09 -47.28 20.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.029 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.1 tt -64.7 -21.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.766 ' HG ' ' H ' ' A' ' 61' ' ' ALA . 2.7 tt -55.06 -44.84 75.15 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.075 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.609 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 81.8 p -65.4 -29.57 70.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -74.19 -14.04 60.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.039 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 52.9 t -88.25 -55.88 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.186 0.517 . . . . 0.0 110.615 171.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.403 HG22 HG22 ' A' ' 37' ' ' ILE . 34.4 p -58.25 -42.51 86.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.579 -173.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.609 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.1 mpt_? -59.14 -55.1 49.81 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.474 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 50.4 Cg_endo -72.18 -14.41 28.68 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.52 1.48 . . . . 0.0 113.17 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -14.09 59.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.806 0.336 . . . . 0.0 110.51 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.458 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 43.6 t -80.9 -13.67 58.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.774 -177.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.73 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.2 p -146.36 149.53 15.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -175.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.706 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 5.7 t60 -60.38 107.78 0.71 Allowed 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.73 ' HG3' HG13 ' A' ' 79' ' ' VAL . 34.6 mtp -140.68 170.36 9.7 Favored Pre-proline 0 CA--C 1.533 0.317 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -167.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.498 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 23.8 Cg_exo -41.25 2.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.865 1 C-N-CA 128.149 5.899 . . . . 0.0 119.125 174.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.6 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.5 -24.37 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 -166.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.868 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -65.2 -57.44 8.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.819 0.819 . . . . 0.0 109.477 170.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.7 ttpt -70.27 -14.45 62.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.732 179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 83' ' ' ALA . 38.2 mt -66.12 -27.09 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 122.06 -0.4 . . . . 0.0 110.539 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.685 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 50.8 t -75.61 -22.87 56.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.611 0.72 . . . . 0.0 109.65 175.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.8 mt-10 -75.64 -38.41 58.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.168 173.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -62.65 -35.99 81.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.647 171.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 87' ' ' CYS . 21.4 mt -61.81 -28.68 69.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.313 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.589 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.7 mmmm -65.85 -24.06 66.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.602 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -81.69 -14.63 56.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.924 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.548 HD12 HD23 ' A' ' 90' ' ' LEU . 96.3 mt -94.37 -39.83 10.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.163 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -162.38 137.47 7.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.974 175.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 41.7 t -85.07 -21.92 29.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.163 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -68.59 -19.71 64.47 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.829 0.347 . . . . 0.0 110.844 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' HB3' ' A' ' 58' ' ' TYR . 51.7 mt -61.0 -30.17 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.305 0.574 . . . . 0.0 110.283 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.589 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 44.3 t -85.96 79.72 9.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.167 176.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 179.37 -139.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.896 174.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.557 ' O ' HG21 ' A' ' 13' ' ' VAL . 6.7 mp 63.63 21.98 12.95 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.739 0.649 . . . . 0.0 111.131 177.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.441 ' HG2' ' OE1' ' A' ' 99' ' ' GLU . 33.4 mmtp -46.15 134.53 8.39 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 123.729 0.643 . . . . 0.0 112.078 -170.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.598 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.0 m-85 . . . . . 0 C--N 1.327 -0.403 0 O-C-N 123.388 0.43 . . . . 0.0 110.934 -174.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo . . . . . 0 N--CA 1.45 -1.053 0 CA-C-O 120.654 0.189 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -85.78 -37.46 9.41 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.818 -1.182 . . . . 0.0 112.271 -177.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LYS . . . 175.33 -109.54 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.19 0.596 . . . . 0.0 109.879 -174.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -149.85 -35.22 0.17 Allowed 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 172.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 91.8 m -67.67 101.98 1.12 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.982 0.42 . . . . 0.0 109.943 173.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 39.3 tt0 -46.3 -59.9 2.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.645 -1.161 . . . . 0.0 113.895 -165.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.967 HG12 HD22 ' A' ' 55' ' ' LEU . 23.1 t -64.11 -47.97 87.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.356 0.598 . . . . 0.0 110.839 -176.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.8 ' HB2' HG22 ' A' ' 97' ' ' ILE . 5.1 t -59.22 -47.07 86.69 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.649 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 10.3 ptmm? -64.81 -38.29 90.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.308 -176.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.682 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 15.8 mm-40 -65.02 -42.9 93.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.605 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -62.61 -51.41 67.41 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.624 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 58.2 mt -62.39 -54.81 34.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.738 -176.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.644 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 28.5 t-20 -58.18 -45.61 87.22 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.271 0.357 . . . . 0.0 111.843 -174.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.442 HH22 ' HG2' ' A' ' 52' ' ' GLU . 87.0 mtm180 -64.11 -50.18 69.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.838 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -55.64 -47.65 76.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.328 1.061 . . . . 0.0 110.185 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.717 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 3.2 t80 -56.89 -52.14 66.32 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.807 -1.997 . . . . 0.0 112.412 -171.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HE2' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -83.46 -23.83 32.06 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.966 -177.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.639 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 42.6 m -57.02 -44.14 82.56 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.645 176.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 4.2 mp -63.91 -28.23 69.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.534 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 50.4 mm -71.63 -46.51 62.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 176.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.17 -46.9 81.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.859 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.86 ' HG3' HG23 ' A' ' 30' ' ' VAL . 20.5 ptp180 -85.31 -13.76 48.64 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.93 49.95 5.41 Favored Glycine 0 C--O 1.228 -0.239 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.439 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 1.011 HG13 HG22 ' A' ' 36' ' ' THR . 59.0 t -118.71 3.46 7.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.688 1.232 . . . . 0.0 110.338 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 31' ' ' ASN . 1.0 OUTLIER -96.92 174.49 6.76 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.303 -170.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 68.38 9.51 7.3 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.875 0.734 . . . . 0.0 112.018 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.465 ' O ' HG13 ' A' ' 37' ' ' ILE . 41.6 m -136.99 110.15 7.78 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.47 -35.14 75.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.313 -172.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.2 -36.24 74.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.375 0.607 . . . . 0.0 110.361 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 1.011 HG22 HG13 ' A' ' 30' ' ' VAL . 19.1 m -74.16 -39.87 62.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.494 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.501 HG22 HG22 ' A' ' 74' ' ' THR . 78.7 mt -61.37 -34.36 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.36 173.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.91 -50.33 69.15 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.909 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -62.28 -42.15 99.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.708 -176.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.535 ' HG3' HG11 ' A' ' 30' ' ' VAL . 26.9 mm-40 -80.68 -16.78 53.09 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.503 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.59 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.3 tp -68.87 -41.23 78.67 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 172.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 1.7 mp -66.42 -41.44 88.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.46 173.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 32.2 t -64.03 -56.1 17.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.632 ' HA ' ' HB3' ' A' ' 47' ' ' ASP . 22.2 t80 -62.73 -28.78 70.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.223 0.535 . . . . 0.0 109.982 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 42' ' ' ILE . 53.8 t -49.2 -52.28 27.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.628 174.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.6 mt -89.55 -18.37 26.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.776 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.632 ' HB3' ' HA ' ' A' ' 44' ' ' PHE . 27.6 t70 -63.83 -29.16 70.38 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 111.173 -177.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.683 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -73.5 -169.63 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.945 177.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -100.37 173.44 6.59 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.365 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -45.56 -41.63 9.51 Favored Glycine 0 C--N 1.332 0.359 0 O-C-N 123.961 0.788 . . . . 0.0 114.453 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -59.45 -53.63 55.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.889 0.345 . . . . 0.0 111.177 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.683 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 2.1 mp0 -75.72 -27.66 58.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.467 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -61.42 -40.46 94.49 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -69.93 -43.42 71.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.197 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.967 HD22 HG12 ' A' ' 13' ' ' VAL . 23.9 tp -55.77 -35.81 66.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.941 178.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.97 -28.14 69.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.084 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -63.88 -31.94 73.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.153 0.501 . . . . 0.0 109.945 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -83.55 -23.21 32.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.357 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.95 -7.69 56.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.987 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.462 ' HA2' ' HB1' ' A' ' 65' ' ' ALA . . . 72.53 43.69 43.61 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.239 -0.891 . . . . 0.0 113.735 171.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.59 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -127.98 23.07 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.499 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -113.02 -117.76 0.31 Allowed 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.092 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.499 ' H ' ' HB ' ' A' ' 62' ' ' THR . 55.7 mtpt -129.05 142.73 50.81 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 60.88 31.42 20.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.723 0.773 . . . . 0.0 109.842 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB1' ' HA2' ' A' ' 60' ' ' GLY . . . -104.23 -178.54 3.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.621 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.508 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -69.39 119.85 14.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.4 p -70.32 -28.02 64.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -72.0 -45.73 59.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.125 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.777 HD11 HD11 ' A' ' 90' ' ' LEU . 14.6 tt -66.03 -28.76 44.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.443 -175.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.463 HD12 HD23 ' A' ' 41' ' ' LEU . 46.5 tp -57.13 -45.53 83.44 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.373 0.606 . . . . 0.0 110.419 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.653 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 17.0 m -71.87 -37.48 70.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.246 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -64.33 -22.9 67.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.967 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 69' ' ' ILE . 94.3 t -86.19 -47.74 16.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.864 174.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.501 HG22 HG22 ' A' ' 37' ' ' ILE . 11.6 p -58.27 -33.64 69.62 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 71' ' ' SER . 5.5 mtt180 -67.29 -55.39 15.55 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.607 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 29.2 Cg_endo -67.34 -16.79 48.86 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.261 1.308 . . . . 0.0 113.01 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.6 mmt -78.2 -14.41 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.641 0.257 . . . . 0.0 111.002 175.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -79.89 -14.73 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.669 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.7 p -150.06 150.09 13.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -176.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.717 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 7.5 t60 -60.9 110.72 1.41 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.182 0.515 . . . . 0.0 110.122 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.669 ' HG3' HG13 ' A' ' 79' ' ' VAL . 48.2 mtp -137.6 173.73 5.11 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.345 -167.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.549 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 2.6 Cg_endo -40.64 0.9 0.0 OUTLIER 'Trans proline' 0 C--O 1.206 -1.081 1 C-N-CA 127.853 5.702 . . . . 0.0 118.863 175.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.591 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.41 -32.31 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.809 1.781 . . . . 0.0 115.809 -161.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 1.5 mtm -54.24 -48.05 71.54 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.965 0.888 . . . . 0.0 109.971 171.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 82' ' ' PRO . 3.1 mptp? -70.34 -29.95 66.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.677 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.591 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 50.2 mt -64.71 -29.73 48.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.052 0.453 . . . . 0.0 110.184 -174.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 52.6 t -61.28 -39.75 91.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.307 0.575 . . . . 0.0 109.993 172.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.51 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 15.8 mm-40 -72.05 -22.28 61.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.742 176.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -72.18 -38.87 69.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.777 HD11 HD11 ' A' ' 69' ' ' ILE . 2.8 mm? -66.76 -27.24 67.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.629 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.585 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.0 mmmm -63.51 -23.26 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.866 176.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -77.5 -17.45 57.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.778 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 mp -95.31 -40.87 9.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.608 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -164.32 135.31 4.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.796 0.332 . . . . 0.0 110.695 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.7 m -86.26 -15.48 40.61 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -67.63 -21.67 65.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.246 0.546 . . . . 0.0 110.341 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.8 HG22 ' HB2' ' A' ' 14' ' ' CYS . 57.3 mt -61.87 -23.58 31.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.33 176.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.585 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 24.2 t -89.43 -48.29 7.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.991 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -102.95 21.81 15.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.913 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.95 -42.91 99.65 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.461 ' HD3' ' HA ' ' A' ' 101' ' ' LYS . 60.7 mmtt 63.79 163.3 0.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.55 -1.205 . . . . 0.0 113.883 174.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.789 179.459 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo . . . . . 0 N--CA 1.448 -1.153 0 CA-C-O 121.117 0.382 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.93 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -84.39 -26.18 40.61 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.808 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.598 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . -172.31 -83.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.119 0.485 . . . . 0.0 111.039 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t70 176.02 -27.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 5.4 m -73.09 -147.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.095 169.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . 35.5 tt0 -130.34 -73.84 0.55 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.117 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.932 HG12 HD22 ' A' ' 55' ' ' LEU . 93.8 t -60.48 -47.92 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.498 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.675 ' HA ' HD21 ' A' ' 55' ' ' LEU . 41.9 t -58.56 -37.69 76.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.185 0.517 . . . . 0.0 110.154 174.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.716 ' HG3' ' CA ' ' A' ' 8' ' ' GLY . 27.7 ttpt -64.65 -55.55 19.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.847 -179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 61.9 mm-40 -58.94 -44.89 91.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.898 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -58.02 -56.66 19.18 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.237 0.335 . . . . 0.0 111.717 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 87' ' ' CYS . 97.9 mt -60.1 -48.32 82.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.722 0.296 . . . . 0.0 111.022 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.93 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.0 t-20 -67.06 -41.72 85.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.355 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -78.05 -34.26 50.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.925 -175.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.46 -47.04 87.52 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.825 0.821 . . . . 0.0 109.246 172.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.725 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.6 t80 -56.59 -49.88 73.6 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 113.604 -1.635 . . . . 0.0 111.22 -177.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -71.57 -31.7 67.26 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.319 -179.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.506 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 73.1 m -60.16 -38.33 82.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.383 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CG2' ' A' ' 30' ' ' VAL . 4.3 mp -73.73 -22.46 59.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.011 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 46.9 mm -80.35 -43.81 21.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.03 -55.18 35.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.806 174.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -78.93 -14.72 59.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.892 -175.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.24 31.66 74.91 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.765 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.662 ' CG2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 m -99.01 3.38 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 122.044 0.926 . . . . 0.0 110.47 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.6 t-20 -83.62 174.15 10.78 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.093 -169.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.2 t80 75.39 -11.03 1.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.006 0.923 . . . . 0.0 110.795 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 37' ' ' ILE . 24.2 m -100.47 105.41 16.86 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.616 HD21 ' HE ' ' A' ' 75' ' ' ARG . 12.3 tp -62.78 -38.04 89.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.812 -171.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -63.0 -42.04 99.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.401 0.619 . . . . 0.0 110.215 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.7 m -67.27 -38.86 85.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.275 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 33' ' ' SER . 73.9 mt -58.18 -34.17 48.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.724 0.297 . . . . 0.0 110.284 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HG3' ' CD2' ' A' ' 70' ' ' LEU . 35.8 tt0 -69.1 -45.26 70.67 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.463 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -62.94 -40.0 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.195 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.569 ' HG3' HG21 ' A' ' 30' ' ' VAL . 10.0 mm-40 -68.65 -39.39 80.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.309 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.639 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 17.9 mt -55.62 -55.64 29.66 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 120.767 0.318 . . . . 0.0 110.144 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.582 HD11 HD11 ' A' ' 70' ' ' LEU . 1.7 mp -57.47 -46.13 85.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.997 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -61.34 -51.09 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.491 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -61.88 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.068 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.8 m -65.4 -28.59 69.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.521 -178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -86.62 -49.26 7.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -82.32 63.8 6.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.424 0.631 . . . . 0.0 111.067 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.401 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -150.92 -161.45 1.34 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.693 178.644 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HG2' ' OE1' ' A' ' 52' ' ' GLU . 13.2 pttm -103.18 166.86 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 121.081 -0.248 . . . . 0.0 111.241 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.36 -43.48 26.96 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 124.068 0.855 . . . . 0.0 114.398 -170.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.811 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.0 mptt -58.37 -47.69 83.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.234 0.517 . . . . 0.0 111.249 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.408 ' OE1' ' HG2' ' A' ' 49' ' ' LYS . 40.7 mt-10 -71.82 -41.08 68.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.507 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -58.09 -44.18 87.49 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -70.01 -41.86 73.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.871 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.932 HD22 HG12 ' A' ' 13' ' ' VAL . 23.5 tp -53.62 -42.78 68.09 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.691 -177.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 86.2 m -67.34 -14.13 62.64 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -72.31 -25.73 61.68 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.543 ' HB3' HG12 ' A' ' 97' ' ' ILE . 77.0 m-85 -84.99 -40.25 17.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.75 175.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 82.5 mt -74.08 -18.8 60.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.39 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.05 -13.5 63.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.293 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -85.59 75.44 10.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.21 0.529 . . . . 0.0 111.582 -176.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.582 HG22 ' H ' ' A' ' 63' ' ' LYS . 5.8 m -152.78 176.77 11.43 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.582 ' H ' HG22 ' A' ' 62' ' ' THR . 29.4 mtpp -63.17 -37.69 88.21 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.63 -152.69 0.32 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.201 -0.908 . . . . 0.0 109.21 174.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.52 -164.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 112.201 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.75 126.8 34.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.567 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.4 p -86.18 -21.16 27.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.993 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -81.28 -44.92 17.01 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.361 -175.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.485 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 13.9 tt -63.33 -24.61 36.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.428 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 42' ' ' ILE . 3.3 tt -60.14 -44.25 95.09 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 174.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.646 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 19.0 m -66.51 -18.87 65.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.01 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 27.8 mm-40 -71.62 -56.08 6.53 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.28 -45.25 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.41 0.444 . . . . 0.0 111.921 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.4 p -55.24 -34.28 63.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.646 ' HD3' ' O ' ' A' ' 71' ' ' SER . 3.1 mpt_? -66.5 -56.45 15.32 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.86 -173.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.681 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 25.8 Cg_endo -65.61 -30.13 51.58 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.624 1.549 . . . . 0.0 112.977 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.2 mmt -67.79 -14.13 62.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.16 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -78.35 -15.27 58.88 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.451 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.569 HG23 ' HG3' ' A' ' 81' ' ' MET . 4.0 m -144.23 -169.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.933 0.397 . . . . 0.0 111.386 -174.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.725 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 58.1 t60 -89.57 99.44 12.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.681 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 38.9 mtp -136.34 169.67 12.89 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -170.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.562 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.1 Cg_endo -42.44 -0.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.935 1 C-N-CA 127.809 5.672 . . . . 0.0 118.128 177.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.646 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.82 -35.07 0.08 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -159.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.65 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -65.72 -51.65 57.58 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 118.664 0.665 . . . . 0.0 110.513 177.014 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.637 ' H ' ' HG2' ' A' ' 84' ' ' MET . 42.7 mtmt -67.21 -19.49 65.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.711 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.646 HD12 ' HA ' ' A' ' 83' ' ' ALA . 27.9 mt -63.86 -28.97 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.912 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.598 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 49.3 t -68.84 -35.07 76.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.717 176.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.872 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 67.7 mm-40 -68.21 -28.54 67.34 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.792 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.498 ' CD ' ' HA ' ' A' ' 86' ' ' ILE . 31.7 mttm -74.72 -40.14 61.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.24 177.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 92.3 mt -68.35 -25.21 64.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.183 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.872 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 58.2 mtpt -61.24 -21.24 63.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.526 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -76.18 -22.16 55.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.099 0.476 . . . . 0.0 110.386 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.2 -53.23 4.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.43 ' OD1' HG13 ' A' ' 97' ' ' ILE . 10.8 t70 -138.18 115.01 10.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.423 177.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.1 m -82.62 -15.01 53.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.792 0.33 . . . . 0.0 111.336 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.426 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 2.1 mp0 -65.74 -34.86 79.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.919 -177.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.543 HG12 ' HB3' ' A' ' 58' ' ' TYR . 78.3 mt -48.04 -42.0 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.47 176.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.623 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 35.9 t -72.68 -42.27 64.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.885 -173.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -81.31 14.5 2.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.67 116.03 21.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 170.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HD3' ' HB3' ' A' ' 12' ' ' GLU . 32.4 mmtp -116.58 149.65 39.31 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.811 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 98.9 m-85 . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 177.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo . . . . . 0 N--CA 1.446 -1.293 0 CA-C-O 121.027 0.345 . . . . 0.0 111.605 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.674 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -96.71 -19.73 26.3 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.439 -176.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.779 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . 173.21 -153.08 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.208 0.603 . . . . 0.0 109.725 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -121.39 -36.67 3.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.641 0.258 . . . . 0.0 110.354 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 42.3 m -56.36 -81.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.869 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 15' ' ' LYS . 7.3 tp10 170.41 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.727 0.299 . . . . 0.0 111.627 172.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.667 HG12 HD22 ' A' ' 55' ' ' LEU . 53.5 t -64.59 -38.16 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.477 -172.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 21.7 p -60.24 -30.71 69.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 174.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -72.18 -41.65 66.75 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.219 -175.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' HH11 ' A' ' 20' ' ' ARG . 43.6 mm-40 -56.23 -48.47 76.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.667 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -61.55 -54.98 35.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.144 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 96.0 mt -59.57 -48.16 82.76 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.502 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.7 t-20 -68.5 -44.75 74.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.466 HH11 ' HB3' ' A' ' 16' ' ' GLU . 30.7 mtp180 -64.63 -39.19 93.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.687 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 76.2 t80 -62.69 -50.24 71.92 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.954 0.883 . . . . 0.0 109.684 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.544 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 29.9 t80 -47.37 -55.06 9.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.84 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.627 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -68.74 -37.74 79.64 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.204 -179.303 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.627 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 27.2 t -59.23 -33.18 70.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.388 0.613 . . . . 0.0 110.758 -175.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.587 ' HA ' HG13 ' A' ' 30' ' ' VAL . 2.9 mp -83.04 -46.69 12.54 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.573 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 28.8 mm -67.34 -37.78 79.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.176 0.513 . . . . 0.0 110.225 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -72.28 -46.07 57.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.407 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.964 ' HG2' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -82.08 -14.15 56.24 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.031 0.443 . . . . 0.0 110.75 -177.028 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.58 1.78 60.28 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.061 172.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.964 HG12 ' HG2' ' A' ' 28' ' ' ARG . 1.9 p -87.94 99.02 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.568 ' HA ' HD11 ' A' ' 37' ' ' ILE . 7.5 t-20 -165.73 -176.96 4.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.969 -0.457 . . . . 0.0 111.253 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 62.5 38.57 12.51 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.35 0.66 . . . . 0.0 111.54 -177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.599 ' O ' HG12 ' A' ' 37' ' ' ILE . 55.5 m -157.8 104.94 1.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.913 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.4 mm? -58.95 -43.68 91.29 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -172.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.46 -38.25 83.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.25 0.548 . . . . 0.0 110.715 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.409 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 48.1 m -73.6 -40.82 63.55 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.333 -178.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 33' ' ' SER . 35.9 mm -58.58 -37.61 65.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -69.46 -44.26 71.58 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 32.3 mmtm -77.0 -18.8 57.96 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.925 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.592 ' HG3' HG21 ' A' ' 30' ' ' VAL . 62.1 mm-40 -85.35 -28.02 25.48 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.933 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HD21 ' A' ' 70' ' ' LEU . 13.2 mt -59.71 -55.46 34.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 168.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.44 HD12 ' HD3' ' A' ' 39' ' ' LYS . 60.4 mt -53.63 -43.85 55.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.069 176.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -63.85 -48.1 78.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.905 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -68.55 -32.92 73.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.854 0.359 . . . . 0.0 110.595 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 91.3 m -66.07 -22.62 66.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.946 0.403 . . . . 0.0 110.872 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.8 tp -87.64 -41.57 13.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.104 172.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -79.17 48.35 0.86 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.731 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -142.05 -172.65 3.62 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.521 177.773 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -97.56 173.46 7.14 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.58 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.51 -43.25 58.59 Favored Glycine 0 C--N 1.33 0.224 0 O-C-N 123.548 0.53 . . . . 0.0 114.022 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.7 tppt? -61.14 -42.25 98.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.135 0.493 . . . . 0.0 110.153 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 20.6 mt-10 -78.27 -37.56 44.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.766 -176.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -57.54 -40.57 79.12 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -78.96 -36.38 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.633 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.667 HD22 HG12 ' A' ' 13' ' ' VAL . 38.3 tp -53.63 -34.62 59.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.569 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 9.2 t -68.12 -15.35 63.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -74.56 -21.09 59.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.292 0.568 . . . . 0.0 109.964 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.551 ' HB3' HG12 ' A' ' 97' ' ' ILE . 98.7 m-85 -86.12 -34.56 20.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.008 174.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.78 -36.11 67.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.503 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.56 -3.76 34.6 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 121.057 -0.592 . . . . 0.0 113.862 172.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 70' ' ' LEU . . . -92.44 53.22 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -173.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -126.07 -84.94 0.62 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.058 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 62' ' ' THR . 27.5 mtpp -146.09 -70.21 0.26 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.138 0.494 . . . . 0.0 110.067 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -126.59 101.62 6.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.958 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -161.18 -79.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.753 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -148.41 60.99 1.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.308 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -68.65 -19.22 64.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.536 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -81.51 -27.28 34.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.026 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.517 ' HB ' HD23 ' A' ' 93' ' ' LEU . 6.7 pt -86.11 -18.93 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-O 121.368 0.604 . . . . 0.0 109.547 175.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 61' ' ' ALA . 2.7 tm? -65.72 -26.85 67.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.712 -173.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.668 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 2.6 m -60.32 -27.85 67.67 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.322 0.582 . . . . 0.0 110.698 178.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.65 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 8.8 tp10 -72.2 -14.69 61.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.406 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.574 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 58.1 t -87.91 -53.22 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.008 0.432 . . . . 0.0 110.484 172.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -55.48 -53.08 60.78 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -172.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.668 ' HD3' ' O ' ' A' ' 71' ' ' SER . 1.5 mtp-105 -58.48 -51.73 79.72 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.686 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.731 ' HB3' ' SD ' ' A' ' 81' ' ' MET . 47.9 Cg_exo -61.52 -39.43 55.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.565 1.51 . . . . 0.0 113.361 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.492 ' HG3' ' HE2' ' A' ' 21' ' ' PHE . 23.8 mmt -61.81 -16.68 51.91 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.882 0.372 . . . . 0.0 111.281 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.567 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 40.6 t -75.31 -11.76 60.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.572 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -136.95 168.67 21.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -71.02 96.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.822 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -118.12 158.78 45.41 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.854 -163.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.822 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 25.0 Cg_exo -40.55 3.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.745 1 C-N-CA 127.831 5.687 . . . . 0.0 118.034 167.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.91 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -163.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.674 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -64.51 -48.56 74.7 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.955 1.252 . . . . 0.0 109.583 173.116 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 34.8 ttmt -66.29 -20.7 66.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.198 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 83' ' ' ALA . 44.8 mt -66.22 -30.85 51.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.059 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 90' ' ' LEU . 50.0 t -78.46 -20.34 51.15 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.887 176.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.592 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 4.8 tp10 -64.34 -50.75 66.55 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 46.8 mtmt -63.17 -33.25 75.06 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.515 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 13.3 mt -61.87 -21.86 65.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.677 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.647 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 26.7 mtmm -64.61 -24.03 67.46 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.964 -176.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 92' ' ' LYS . 24.6 tptp -79.78 -19.09 49.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.205 0.526 . . . . 0.0 110.254 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.8 mp -85.87 -48.16 9.0 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -160.44 122.61 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.992 174.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -84.37 -14.01 50.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.007 0.432 . . . . 0.0 110.959 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -75.28 -14.29 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.551 HG12 ' HB3' ' A' ' 58' ' ' TYR . 83.3 mt -60.61 -33.05 53.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 122.001 0.905 . . . . 0.0 109.181 170.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.647 ' SG ' ' HG2' ' A' ' 91' ' ' LYS . 90.9 m -87.67 -51.4 5.9 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.597 -177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.09 43.94 1.04 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.195 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.556 ' O ' HG21 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -111.53 48.76 0.93 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -62.01 158.04 17.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.395 -172.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.464 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 71.2 m-85 . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.952 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 N--CA 1.46 -0.49 0 N-CA-C 111.01 -0.419 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.958 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -66.77 -41.2 93.79 Favored Glycine 0 N--CA 1.439 -1.132 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.525 -169.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.615 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -179.51 -82.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.545 0.688 . . . . 0.0 110.953 -173.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -165.21 -70.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.635 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 p -68.33 128.92 38.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.429 175.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.673 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 34.2 mp0 -48.26 -76.92 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.84 HG12 HD22 ' A' ' 55' ' ' LEU . 59.3 t -51.73 -42.47 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.3 t -63.87 -46.23 85.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.073 0.463 . . . . 0.0 110.27 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.1 ptmt -68.96 -36.52 78.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.435 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.1 mm-40 -61.84 -51.38 68.47 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.096 -178.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -65.01 -54.51 29.29 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.334 -176.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.568 HD12 ' SG ' ' A' ' 87' ' ' CYS . 71.3 mt -58.08 -52.95 63.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -174.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.958 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -68.54 -36.2 78.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.937 0.399 . . . . 0.0 111.309 -175.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.2 ttm180 -73.68 -39.12 64.63 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.33 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.535 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 87.3 t80 -61.84 -49.37 76.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.589 0.709 . . . . 0.0 109.241 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.455 ' O ' HG12 ' A' ' 26' ' ' ILE . 40.8 t80 -48.86 -47.89 42.41 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.05 178.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -77.57 -46.93 20.75 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.6 t -57.7 -29.03 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.092 0.473 . . . . 0.0 110.683 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 3.9 tp -72.03 -41.61 67.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.446 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 22' ' ' TYR . 40.7 mm -68.66 -36.67 75.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.488 0.661 . . . . 0.0 109.637 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.39 -45.67 86.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.387 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 28' ' ' ARG . 18.1 mtp180 -70.19 -26.1 63.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.404 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.95 12.44 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.564 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.672 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.41 126.7 71.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 114.749 -0.725 . . . . 0.0 109.339 -178.464 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.537 ' O ' HD11 ' A' ' 37' ' ' ILE . 2.0 t-20 -173.91 -45.18 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 175.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -79.54 47.36 0.82 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.335 0.588 . . . . 0.0 111.784 -173.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 37' ' ' ILE . 20.4 m -157.88 109.56 2.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.825 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.569 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.9 mm? -57.88 -41.64 82.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.977 -176.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -59.09 -41.95 89.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.232 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -70.72 -42.65 70.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.514 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.537 HD11 ' O ' ' A' ' 31' ' ' ASN . 67.3 mt -57.69 -37.39 59.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -71.16 -47.24 58.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.086 -178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.676 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -60.97 -43.38 98.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.482 ' HG3' HG21 ' A' ' 30' ' ' VAL . 4.8 mm-40 -78.55 -27.04 45.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -176.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.535 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 6.2 mt -59.28 -48.83 80.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.51 -47.27 85.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.67 175.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.5 m -60.05 -47.28 86.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.299 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -71.09 -38.51 72.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.48 -175.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.452 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 54.5 m -66.62 -28.65 68.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -86.02 -20.14 29.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.093 0.473 . . . . 0.0 110.641 176.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -87.47 -24.64 24.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.314 -175.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -70.13 -173.76 0.72 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.846 -179.445 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -96.34 174.36 6.91 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.284 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.01 -47.86 39.68 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 114.758 0.663 . . . . 0.0 114.758 -169.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -61.2 -36.35 79.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.258 0.529 . . . . 0.0 111.371 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.0 mt-10 -80.67 -38.75 28.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.094 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.1 -47.32 83.61 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -64.35 -38.5 91.25 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.735 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.84 HD22 HG12 ' A' ' 13' ' ' VAL . 34.1 tp -57.88 -36.87 72.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.5 m -70.92 -17.39 62.69 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.72 -29.7 67.16 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -86.17 -38.61 17.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.36 177.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.1 mt -73.22 -25.88 60.91 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.571 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.618 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.12 -9.52 42.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.487 174.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -81.78 55.85 2.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.724 0.773 . . . . 0.0 111.118 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 64' ' ' ASP . 24.8 m -156.82 140.71 16.19 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -75.68 19.72 0.19 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.039 0.447 . . . . 0.0 112.023 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 62' ' ' THR . 1.2 m-20 -127.16 1.93 6.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.886 176.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.92 -174.16 2.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.775 -172.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.421 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -67.66 136.51 54.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.961 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 p -84.41 -35.52 23.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.854 -175.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -72.88 -22.49 60.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.07 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.618 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.1 tt -85.67 -24.92 6.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.256 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.614 HD13 ' HA ' ' A' ' 61' ' ' ALA . 21.2 tp -61.5 -43.55 98.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.439 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 16.0 p -68.57 -23.01 64.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -75.89 -19.94 58.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.652 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.44 ' O ' ' HG2' ' A' ' 77' ' ' MET . 48.3 t -88.73 -52.09 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.282 172.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.511 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 18.4 p -55.27 -49.45 72.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.604 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.0 mpt_? -55.46 -54.59 49.41 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -176.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.459 ' HB3' ' HE2' ' A' ' 81' ' ' MET . 27.7 Cg_endo -66.49 -13.27 39.22 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.898 1.732 . . . . 0.0 114.41 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 24.4 mmt -77.25 -25.38 51.47 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.087 176.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 t -73.63 -13.97 61.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.202 -175.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.37 163.53 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.42 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 75.2 t60 -70.14 89.28 0.63 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.36 0.527 . . . . 0.0 110.201 178.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.496 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 5.3 mtp -110.29 176.86 1.37 Allowed Pre-proline 0 C--N 1.318 -0.767 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.337 -176.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.545 ' O ' HG13 ' A' ' 86' ' ' ILE . 33.1 Cg_exo -42.69 -0.17 0.01 OUTLIER 'Trans proline' 0 C--O 1.212 -0.801 1 C-N-CA 126.113 4.542 . . . . 0.0 116.904 171.162 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.748 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.55 -41.07 0.64 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.133 1.333 . . . . 0.0 114.052 -169.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.696 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -61.98 -56.87 14.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.043 0.925 . . . . 0.0 109.543 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 39.3 ttmt -62.07 -14.53 37.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.232 178.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 83' ' ' ALA . 42.0 mt -70.51 -26.01 27.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 O-C-N 122.037 -0.414 . . . . 0.0 111.3 -177.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.568 ' SG ' HD12 ' A' ' 18' ' ' LEU . 84.8 m -73.05 -17.48 61.42 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.816 0.817 . . . . 0.0 110.213 173.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.9 mt-10 -85.94 -45.34 11.59 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.187 171.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 86' ' ' ILE . 26.4 ttpp -64.06 -38.18 90.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.384 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.19 -14.48 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -66.82 -14.92 63.21 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.953 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -67.36 -29.13 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.463 0.649 . . . . 0.0 109.56 173.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.6 mp -94.23 -47.41 6.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.109 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.411 ' OD2' HG13 ' A' ' 97' ' ' ILE . 23.4 t70 -161.27 124.15 3.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.022 -179.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.4 p -86.82 -16.16 37.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.739 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.666 ' HA ' ' HG2' ' A' ' 99' ' ' GLU . 1.9 mp0 -72.15 -19.67 61.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.717 0.294 . . . . 0.0 111.346 -175.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.411 HG13 ' OD2' ' A' ' 94' ' ' ASP . 71.3 mt -54.66 -30.8 22.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.332 0.587 . . . . 0.0 110.585 174.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 13.3 m -82.45 -24.76 34.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.592 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.666 ' HG2' ' HA ' ' A' ' 96' ' ' GLN . 11.8 pt-20 -100.6 20.65 14.69 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.45 -63.6 1.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt 66.19 131.7 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.748 177.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.278 179.689 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo . . . . . 0 N--CA 1.444 -1.389 0 CA-C-O 120.793 0.247 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.771 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -88.09 -23.17 38.89 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.883 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.534 ' N ' ' HG2' ' A' ' 15' ' ' LYS . . . 172.92 -129.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.33 -0.935 . . . . 0.0 108.487 -175.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -139.3 -33.38 0.62 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 169.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.618 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 26.5 m -60.38 106.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.976 167.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -48.88 -69.52 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -165.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.546 HG11 ' HB2' ' A' ' 100' ' ' LEU . 14.3 p -59.46 -31.37 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.613 0.721 . . . . 0.0 110.52 -174.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 11' ' ' CYS . 51.2 t -69.88 -35.81 74.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.371 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 11' ' ' CYS . 55.9 mtpt -57.04 -53.79 54.05 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.266 0.555 . . . . 0.0 109.915 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.534 ' HB3' HH11 ' A' ' 20' ' ' ARG . 13.5 mm-40 -53.7 -51.78 62.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.318 -177.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.663 ' HE2' ' HA ' ' A' ' 45' ' ' CYS . 43.6 t80 -61.4 -55.44 31.38 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.86 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.95 -49.41 77.55 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -174.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.771 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 25.5 t-20 -68.56 -46.8 68.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.354 -174.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.534 HH11 ' HB3' ' A' ' 16' ' ' GLU . 46.2 mtp180 -63.18 -41.27 99.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.114 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.03 -48.67 80.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.622 0.725 . . . . 0.0 109.827 175.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.664 ' HE2' ' H ' ' A' ' 81' ' ' MET . 47.9 t80 -51.91 -55.85 17.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.201 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -73.51 -30.23 62.99 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.329 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.602 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 71.9 m -64.62 -45.85 85.13 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 121.205 -0.198 . . . . 0.0 110.47 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.2 mp -63.46 -41.41 98.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.588 0.233 . . . . 0.0 111.36 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.533 HG12 ' O ' ' A' ' 22' ' ' TYR . 39.7 mm -67.23 -40.03 84.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.057 0.456 . . . . 0.0 110.278 177.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.57 -44.94 73.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.148 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 28' ' ' ARG . 10.2 mtp180 -72.04 -15.26 62.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.1 39.43 27.39 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.628 HG21 ' HG3' ' A' ' 40' ' ' GLU . 0.7 OUTLIER -130.92 98.76 3.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.204 0.526 . . . . 0.0 110.123 -177.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.4 HD22 ' CD1' ' A' ' 37' ' ' ILE . 1.4 t-20 -168.49 -177.83 3.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.057 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 57.3 31.98 21.01 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.289 0.566 . . . . 0.0 111.515 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.588 ' O ' HG12 ' A' ' 37' ' ' ILE . 62.8 m -150.75 107.56 3.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 176.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.706 HD13 ' HE ' ' A' ' 75' ' ' ARG . 95.1 mt -60.09 -41.64 92.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.391 -170.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -67.59 -28.94 68.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.257 0.551 . . . . 0.0 109.874 -178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 m -78.14 -37.5 45.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.859 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 33' ' ' SER . 17.0 mm -64.6 -32.54 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.476 ' CG ' HG21 ' A' ' 74' ' ' THR . 41.1 mt-10 -66.01 -23.68 66.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.694 178.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -85.77 -52.48 5.74 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.147 0.498 . . . . 0.0 110.382 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.628 ' HG3' HG21 ' A' ' 30' ' ' VAL . 7.1 mm-40 -71.64 -25.9 62.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.46 -171.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 7.3 mt -58.45 -38.38 77.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 171.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.1 mt -74.71 -45.96 43.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.144 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 m -57.58 -45.21 85.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.177 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -78.3 -32.93 49.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.954 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.663 ' HA ' ' HE2' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -73.06 -19.41 61.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.342 0.591 . . . . 0.0 110.14 -179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.0 tp -86.35 -41.23 14.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.044 170.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.73 63.61 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.661 0.743 . . . . 0.0 110.492 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.742 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -158.71 -172.42 3.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.595 -179.146 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -98.71 171.49 8.07 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.061 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.69 -43.88 38.12 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 123.644 0.59 . . . . 0.0 114.573 -171.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 7.7 tptp -63.09 -35.36 80.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.312 0.577 . . . . 0.0 110.681 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.742 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 16.0 mt-10 -85.48 -36.43 20.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.242 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.578 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 14.1 m120 -61.39 -39.06 89.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.552 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 19.7 tpt180 -75.08 -35.72 61.79 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.1 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD13 HD12 ' A' ' 100' ' ' LEU . 49.6 tp -58.66 -25.18 62.51 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.333 0.587 . . . . 0.0 110.361 175.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 53' ' ' ASN . 13.2 t -62.29 -32.38 73.09 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.391 176.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -74.91 -17.92 60.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 0.0 109.807 177.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.68 ' HB3' HG12 ' A' ' 97' ' ' ILE . 84.8 m-85 -86.08 -55.13 4.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.904 176.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.8 -18.36 65.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.642 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 82.64 36.13 17.37 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.416 175.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.404 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -93.63 16.87 12.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.215 0.531 . . . . 0.0 110.587 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.489 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -132.91 128.58 36.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.468 178.097 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 67' ' ' THR . 54.9 mtpt -76.91 -10.3 59.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.182 0.515 . . . . 0.0 110.262 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -74.86 -14.82 60.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.039 174.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.29 -139.65 0.32 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.872 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.63 102.04 0.06 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.158 0.504 . . . . 0.0 109.93 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.469 HG23 ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -86.39 -37.84 17.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.149 -169.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -72.28 -35.96 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.511 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.642 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.3 tt -64.12 -23.85 34.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.266 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.97 -49.95 70.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.462 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 8.0 m -66.48 -27.19 67.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.753 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -75.29 -21.51 58.44 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.064 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.537 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.0 t -87.21 -41.91 14.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.943 173.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.476 HG21 ' CG ' ' A' ' 38' ' ' GLU . 39.7 p -60.68 -42.03 96.3 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.706 ' HE ' HD13 ' A' ' 34' ' ' LEU . 4.3 mpt_? -55.69 -53.47 62.36 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.517 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.537 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 31.8 Cg_exo -62.52 -45.78 13.56 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.865 1.71 . . . . 0.0 112.828 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 14.3 mmt -62.78 -14.81 49.5 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB2' HD23 ' A' ' 34' ' ' LEU . 40.4 t -66.79 -14.45 62.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.423 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.02 162.26 34.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -61.63 107.1 0.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 175.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.843 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -119.68 153.42 54.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -163.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.843 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 24.9 Cg_exo -40.56 3.48 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.952 1 C-N-CA 127.923 5.749 . . . . 0.0 117.919 167.183 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.729 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.59 -31.7 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 115.618 1.71 . . . . 0.0 115.618 -164.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.496 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -50.93 -49.32 60.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.462 0.648 . . . . 0.0 110.257 173.158 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 18.0 ptpt -85.81 -15.16 42.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.474 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.808 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 15.2 mt -59.39 -42.67 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HD12 ' A' ' 90' ' ' LEU . 19.4 t -67.32 -22.07 65.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.286 0.565 . . . . 0.0 111.102 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 15.5 tp10 -76.41 -44.16 37.25 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.808 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 10.1 mtmp? -61.11 -24.96 66.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.17 176.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 87' ' ' CYS . 23.1 mt -66.75 -17.82 65.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.264 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -63.53 -20.62 65.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.782 0.325 . . . . 0.0 110.806 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -69.04 -29.51 67.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.181 0.515 . . . . 0.0 110.333 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.56 -59.49 2.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.321 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -151.33 134.2 15.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.345 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.9 m -85.24 -19.55 31.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.465 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -68.07 -30.87 70.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.894 0.378 . . . . 0.0 110.668 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.68 HG12 ' HB3' ' A' ' 58' ' ' TYR . 20.2 mt -56.55 -33.55 39.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.234 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.609 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 53.7 t -75.04 -35.98 61.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.748 -174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -85.99 -107.92 0.05 Allowed 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.298 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 55' ' ' LEU . 73.7 mt 64.39 -69.45 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.888 0.475 . . . . 0.0 111.059 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 70.2 149.25 0.08 Allowed 'General case' 0 C--O 1.231 0.119 0 O-C-N 123.931 0.769 . . . . 0.0 110.836 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.357 174.125 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.444 -1.436 0 N-CA-C 111.226 -0.336 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.599 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -76.14 -29.94 57.91 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 119.065 -1.541 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.467 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.43 -94.08 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.481 -0.86 . . . . 0.0 109.201 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.444 ' HB3' ' CD ' ' A' ' 88' ' ' GLU . 19.3 t70 -164.25 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 170.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 92.5 m -59.8 166.72 2.47 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.402 166.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 40.2 tt0 -89.77 -77.73 0.38 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -167.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.852 HG12 HD22 ' A' ' 55' ' ' LEU . 59.6 t -55.04 -42.57 65.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.289 0.566 . . . . 0.0 111.322 -170.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.673 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.8 t -63.51 -36.0 82.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.73 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 16' ' ' GLU . 2.5 ptpp? -69.25 -35.61 76.29 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.68 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.528 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 61.7 mm-40 -56.88 -55.15 38.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.628 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -57.42 -55.04 39.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.821 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.577 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.0 mt -61.5 -38.84 88.78 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.048 -173.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -64.45 -55.36 21.39 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.17 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.57 -55.56 24.6 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 176.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.24 -50.71 61.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.529 0.68 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.586 ' O ' HG12 ' A' ' 26' ' ' ILE . 54.9 t80 -53.79 -55.27 27.95 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 113.998 -1.456 . . . . 0.0 111.257 -178.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.501 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.95 -34.02 59.84 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.527 -176.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 75.2 m -58.29 -46.26 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.664 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.605 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 2.4 mp -66.33 -44.91 81.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.072 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 22' ' ' TYR . 48.6 mm -59.88 -38.69 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.608 177.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -64.1 -39.38 93.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.864 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB3' HG23 ' A' ' 30' ' ' VAL . 32.6 mtm180 -83.23 -14.85 52.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.115 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.0 15.35 62.99 Favored Glycine 0 N--CA 1.453 -0.177 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.605 ' HB ' ' HG ' ' A' ' 25' ' ' LEU . 43.7 t -93.74 106.0 17.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 114.245 -0.978 . . . . 0.0 110.043 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.758 ' HA ' HD11 ' A' ' 37' ' ' ILE . 1.0 OUTLIER -164.43 -55.26 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 118.499 -1.28 . . . . 0.0 114.212 176.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -78.74 59.04 2.43 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.637 0.732 . . . . 0.0 110.575 -174.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.8 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 13.5 m -157.95 101.65 1.79 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.063 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.45 -46.74 76.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.807 -176.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.93 -30.68 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.279 0.561 . . . . 0.0 110.47 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.8 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 51.6 m -76.02 -46.33 29.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.498 -177.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.758 HD11 ' HA ' ' A' ' 31' ' ' ASN . 32.3 mm -58.52 -33.8 49.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -63.27 -50.71 69.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.884 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -65.21 -39.0 92.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.357 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.509 ' HG3' HG11 ' A' ' 30' ' ' VAL . 53.6 mm-40 -70.19 -40.64 74.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.299 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.566 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 16.8 mt -55.5 -55.54 30.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 59.2 mt -54.76 -47.43 74.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.429 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.4 m -63.93 -51.27 65.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.503 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -67.05 -35.37 79.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.052 0.453 . . . . 0.0 110.353 -176.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.97 -33.63 75.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.243 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.1 mm? -87.63 -20.73 25.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.904 0.383 . . . . 0.0 111.419 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.68 -31.57 61.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.062 0.458 . . . . 0.0 111.262 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.769 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -69.66 -170.42 0.3 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.876 -178.255 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -95.82 171.18 8.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.113 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -42.68 43.63 Favored Glycine 0 N--CA 1.453 -0.205 0 O-C-N 123.687 0.617 . . . . 0.0 114.408 -169.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 14.8 tptt -61.81 -39.27 91.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.519 0.676 . . . . 0.0 110.317 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.769 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.0 mt-10 -80.81 -35.99 32.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.36 -175.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.455 HD21 ' C ' ' A' ' 48' ' ' THR . 3.9 m120 -63.42 -43.41 97.58 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.573 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 12.6 tpt180 -63.12 -37.38 86.97 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.661 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.852 HD22 HG12 ' A' ' 13' ' ' VAL . 61.6 tp -56.18 -45.09 79.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.633 176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 57.3 m -71.01 -14.52 62.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.067 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 9.9 m-85 -65.45 -32.21 73.71 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 172.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.544 ' HB3' HG12 ' A' ' 97' ' ' ILE . 91.1 m-85 -85.74 -39.11 17.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.267 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 95.8 mt -66.84 -19.84 65.81 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.891 177.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.558 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 86.79 12.12 69.46 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.023 174.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -98.55 19.12 15.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.064 0.459 . . . . 0.0 111.894 -174.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.1 p -102.06 160.51 14.45 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -75.74 -4.7 41.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -168.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -124.4 19.55 8.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.12 0.486 . . . . 0.0 110.318 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.74 -178.3 3.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.775 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.69 119.39 18.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.59 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.5 p -74.06 -17.3 60.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.771 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -58.46 -50.5 73.51 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.558 HG23 ' HA3' ' A' ' 60' ' ' GLY . 12.9 tt -75.44 -31.08 23.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.184 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.0 tt -56.3 -55.16 36.82 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.469 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 8.1 p -67.03 -29.62 69.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.072 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.48 -22.74 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.03 0.443 . . . . 0.0 110.41 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.675 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 98.1 t -85.81 -48.81 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.484 175.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 37' ' ' ILE . 41.3 p -61.01 -36.91 80.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 71' ' ' SER . 2.1 mpp_? -54.47 -56.07 30.73 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.546 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.675 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 11.8 Cg_exo -71.67 -36.72 6.1 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.579 1.52 . . . . 0.0 112.436 174.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.449 ' HB2' ' HA ' ' A' ' 74' ' ' THR . 3.8 mmt -59.46 -20.52 55.77 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -60.8 -13.64 16.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.3 m -126.45 174.74 9.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -64.89 88.21 0.06 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.807 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 14.1 tpt -103.28 149.58 37.1 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -162.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.807 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 23.4 Cg_exo -41.41 3.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 127.771 5.647 . . . . 0.0 117.978 168.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.523 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.44 -27.52 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -165.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.599 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -53.12 -49.0 67.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.808 0.813 . . . . 0.0 109.476 171.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE3' ' HB3' ' A' ' 82' ' ' PRO . 41.1 mtmt -74.01 -30.41 62.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.315 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.551 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 39.6 mt -60.53 -41.44 87.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.942 -174.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.577 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 43.9 t -63.07 -33.0 74.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.318 0.58 . . . . 0.0 110.93 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.444 ' CD ' ' HB3' ' A' ' 10' ' ' ASP . 69.6 mm-40 -74.81 -36.07 62.47 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.119 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.18 -28.24 66.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.015 175.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.449 ' HA ' HD13 ' A' ' 93' ' ' LEU . 28.8 mt -71.04 -15.77 62.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.302 177.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -69.8 -16.12 63.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 0.0 110.334 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -68.92 -24.95 64.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.6 176.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 90' ' ' LEU . 7.0 mp -80.91 -53.53 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.719 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HB3' HG13 ' A' ' 97' ' ' ILE . 24.2 t70 -164.66 143.16 6.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.846 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.2 p -79.34 -22.75 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -173.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -73.12 -20.29 60.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.544 HG12 ' HB3' ' A' ' 58' ' ' TYR . 10.1 mt -62.97 -33.1 58.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.177 -178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 14' ' ' CYS . 12.4 p -104.63 -28.45 11.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.855 0.36 . . . . 0.0 110.935 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -76.12 -94.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.169 -171.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 25.3 mt 65.71 -63.56 0.21 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.807 0.692 . . . . 0.0 111.948 -177.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 71.01 123.59 0.03 OUTLIER 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.658 0.783 . . . . 0.0 111.192 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.775 176.116 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.447 -1.216 0 CA-C-O 121.077 0.365 . . . . 0.0 111.512 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.765 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -65.73 -34.11 87.89 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.456 -0.878 . . . . 0.0 110.931 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -176.01 -136.64 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.228 -0.986 . . . . 0.0 108.638 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -121.8 -52.62 2.0 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.633 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 3.1 m -54.8 95.42 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.221 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.522 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 42.0 tp10 -41.14 -58.0 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -168.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.873 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -60.49 -52.36 62.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.131 0.491 . . . . 0.0 111.191 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HA ' HD21 ' A' ' 55' ' ' LEU . 3.0 t -62.49 -35.73 80.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.495 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.563 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 3.3 ttmt -56.46 -52.74 63.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.795 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.5 ' N ' ' HG2' ' A' ' 15' ' ' LYS . 55.2 mm-40 -56.57 -48.94 76.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.628 178.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -57.37 -50.44 72.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.747 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.862 HD11 ' HB2' ' A' ' 87' ' ' CYS . 98.0 mt -58.83 -55.93 28.72 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -175.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.765 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -66.23 -39.86 89.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.684 0.278 . . . . 0.0 111.311 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 -68.05 -36.38 79.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.697 0.284 . . . . 0.0 110.557 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.94 -46.45 68.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.805 0.812 . . . . 0.0 109.427 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.465 ' O ' HG12 ' A' ' 26' ' ' ILE . 86.1 t80 -48.48 -52.88 20.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.521 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.631 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -74.4 -36.38 63.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.631 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 72.2 m -63.73 -31.81 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 25' ' ' LEU . 1.1 tp -75.84 -24.01 55.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.768 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 22' ' ' TYR . 45.2 mm -84.07 -37.09 12.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -56.35 -54.9 40.07 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.249 172.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -78.23 -20.5 51.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.838 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.73 28.37 70.94 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.285 174.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.549 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.0 OUTLIER -100.1 9.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 122.402 1.096 . . . . 0.0 110.073 -176.332 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.49 ' ND2' HD23 ' A' ' 25' ' ' LEU . 2.4 t-20 -88.45 8.33 28.44 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.991 -1.459 . . . . 0.0 112.388 -164.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -108.14 8.4 28.03 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.48 -177.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.476 ' O ' HG13 ' A' ' 37' ' ' ILE . 14.8 m -124.94 118.72 26.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.002 175.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -62.03 -41.17 97.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.268 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -66.1 -29.29 69.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.583 0.706 . . . . 0.0 109.767 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.9 m -76.59 -42.75 41.43 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.522 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 33' ' ' SER . 73.0 mt -58.12 -34.96 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.448 ' O ' HG13 ' A' ' 42' ' ' ILE . 35.7 tt0 -63.86 -52.32 60.58 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.834 178.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -67.5 -36.22 80.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.071 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.549 ' HG3' HG21 ' A' ' 30' ' ' VAL . 8.5 mm-40 -67.36 -38.16 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.382 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 20.1 tp -60.28 -36.39 77.72 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 38' ' ' GLU . 85.9 mt -67.79 -50.54 59.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.714 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -59.39 -42.77 92.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.408 -179.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.35 -32.79 72.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.153 0.501 . . . . 0.0 109.837 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 2.2 t -68.29 -31.87 71.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.327 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.5 tp -85.27 -30.97 23.36 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.266 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -97.1 51.99 1.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.823 0.82 . . . . 0.0 110.551 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.7 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -141.93 -170.13 3.07 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.23 178.073 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.492 ' HD2' ' N ' ' A' ' 49' ' ' LYS . 10.8 mptt -97.16 166.12 11.73 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.536 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.32 -43.29 19.36 Favored Glycine 0 C--N 1.329 0.187 0 O-C-N 123.876 0.735 . . . . 0.0 114.471 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.427 ' HD3' ' HA ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -61.55 -36.33 80.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.103 0.477 . . . . 0.0 110.716 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.3 mt-10 -85.09 -34.76 22.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.158 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.27 -43.31 96.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 23.2 tpt180 -72.25 -35.2 68.74 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.488 177.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.873 HD22 HG12 ' A' ' 13' ' ' VAL . 57.8 tp -56.35 -39.05 72.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.384 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.697 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -71.28 -15.07 62.41 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.139 -176.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.1 m-85 -66.32 -34.23 77.51 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.163 0.506 . . . . 0.0 109.665 174.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 97' ' ' ILE . 24.1 m-85 -83.3 -23.77 32.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.712 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.507 ' CD2' HD11 ' A' ' 97' ' ' ILE . 22.5 mt -79.38 -19.33 50.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.15 173.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 65' ' ' ALA . . . 92.78 0.32 69.16 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 113.475 175.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.574 ' HB2' ' HG ' ' A' ' 41' ' ' LEU . . . -60.95 -33.73 73.64 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -172.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.697 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -74.26 -8.37 56.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.403 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm 68.69 -7.16 0.75 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.145 0.578 . . . . 0.0 111.403 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 62' ' ' THR . 19.6 t70 -72.03 -23.96 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.863 0.84 . . . . 0.0 109.245 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.608 ' HB3' ' HA2' ' A' ' 60' ' ' GLY . . . -90.94 -167.52 1.84 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.69 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.652 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -62.84 133.29 54.49 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.091 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.56 -21.3 52.72 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -77.85 -26.26 49.26 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.949 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 66' ' ' ALA . 15.0 pt -76.35 -22.87 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 120.964 0.411 . . . . 0.0 110.203 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.34 -48.68 72.16 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.71 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 18.9 m -63.16 -34.17 77.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.218 174.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HB3' ' O ' ' A' ' 69' ' ' ILE . 12.4 tp10 -53.74 -33.52 55.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.236 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.69 -53.57 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.324 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.62 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 41.8 p -58.92 -33.56 70.71 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.71 ' HG2' ' O ' ' A' ' 71' ' ' SER . 21.6 mmt180 -64.43 -57.45 17.29 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.214 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 49.3 Cg_endo -71.11 -15.62 32.07 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.857 1.704 . . . . 0.0 112.74 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.8 mmt -73.05 -19.98 61.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.419 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.43 ' HA ' HD11 ' A' ' 37' ' ' ILE . 23.5 t -61.78 -13.61 25.27 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.789 HG13 ' HG3' ' A' ' 81' ' ' MET . 13.3 p -153.48 148.26 13.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -48.07 111.83 0.49 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.041 0.448 . . . . 0.0 110.424 176.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.789 ' HG3' HG13 ' A' ' 79' ' ' VAL . 21.6 mtp -144.7 178.98 1.26 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -166.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.591 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 33.8 Cg_exo -37.43 1.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.189 1 C-N-CA 127.92 5.747 . . . . 0.0 118.535 170.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.623 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.28 -38.35 0.22 Allowed 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.838 1.199 . . . . 0.0 113.892 -170.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.809 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -51.76 -50.33 60.85 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.4 . . . . 0.0 111.128 176.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.67 ' H ' ' HG2' ' A' ' 84' ' ' MET . 6.3 ptmt -88.2 -14.63 38.08 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.237 -0.29 . . . . 0.0 111.377 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.623 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 31.2 mt -59.71 -44.1 92.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.614 0.245 . . . . 0.0 110.846 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.862 ' HB2' HD11 ' A' ' 18' ' ' LEU . 42.6 t -65.89 -21.13 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.276 0.56 . . . . 0.0 111.211 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -82.88 -34.71 26.64 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.0 mttt -62.67 -31.42 72.3 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.478 0.656 . . . . 0.0 109.812 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 87' ' ' CYS . 74.1 mt -66.74 -14.8 63.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.951 -177.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 41.7 mtpt -67.2 -17.49 64.84 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.698 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -66.15 -29.77 70.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.563 . . . . 0.0 109.689 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 60.1 mt -90.42 -50.22 6.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.101 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 16.6 t70 -147.71 132.42 17.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.067 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.3 m -87.44 -20.79 26.12 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.424 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.1 tp60 -78.89 -30.12 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.739 -174.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.531 ' HB ' ' HB3' ' A' ' 58' ' ' TYR . 10.3 tt -54.25 -29.18 19.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.854 0.835 . . . . 0.0 110.109 173.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.633 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 45.1 t -86.3 -58.71 2.52 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.624 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -96.17 42.89 1.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.798 -173.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.2 tp -70.57 -56.63 6.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.956 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 69.38 135.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 O-C-N 124.122 0.889 . . . . 0.0 112.016 177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.683 174.903 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.449 -1.117 0 N-CA-C 109.999 -0.808 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.952 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -78.65 -39.87 20.03 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.4 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HB1' ' CB ' ' A' ' 87' ' ' CYS . . . -173.67 -90.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.834 0.35 . . . . 0.0 110.347 -176.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -152.58 -71.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.584 ' HB2' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -81.18 146.52 30.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -46.78 -56.79 5.65 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -171.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.836 HG12 HD22 ' A' ' 55' ' ' LEU . 58.7 t -61.13 -50.98 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 117.958 0.345 . . . . 0.0 111.742 -173.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HA ' HD21 ' A' ' 55' ' ' LEU . 49.9 t -60.62 -33.87 73.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.525 0.678 . . . . 0.0 109.913 176.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.81 ' HG3' ' HA3' ' A' ' 8' ' ' GLY . 24.0 ttmt -67.17 -48.8 66.88 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.282 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.67 -42.93 84.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.843 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -66.35 -57.01 8.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 80.0 mt -67.18 -39.05 86.35 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.157 -173.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.952 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 27.3 t-20 -68.7 -55.9 9.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -176.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 -64.28 -32.95 74.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.433 0.161 . . . . 0.0 111.433 -178.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -64.12 -47.28 80.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.982 0.896 . . . . 0.0 109.622 174.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 49.8 t80 -57.96 -55.94 28.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.868 -177.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -71.46 -26.84 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.259 -176.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.41 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 46.1 t -65.91 -47.56 74.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.923 0.392 . . . . 0.0 110.2 176.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -60.07 -48.37 82.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.605 -179.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 22' ' ' TYR . 43.3 mm -62.2 -45.51 98.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.702 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -70.75 -38.13 73.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.374 -177.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.479 ' HB2' HG12 ' A' ' 30' ' ' VAL . 60.0 mtm180 -76.32 -13.64 60.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 111.726 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.51 38.31 57.85 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.7 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 1.9 p -125.07 91.31 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.295 -0.452 . . . . 0.0 110.042 -176.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -168.88 -170.29 1.14 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.026 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 62.38 35.11 15.17 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.605 ' O ' HG12 ' A' ' 37' ' ' ILE . 47.2 m -155.28 101.15 2.2 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.483 HD11 ' HD2' ' A' ' 75' ' ' ARG . 3.2 mm? -47.16 -43.94 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.16 -46.63 85.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.642 . . . . 0.0 110.458 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.6 m -71.14 -35.48 71.71 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.673 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 33' ' ' SER . 14.9 mm -55.4 -34.27 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.089 0.471 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -61.36 -47.79 84.26 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.914 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -66.63 -36.78 83.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.097 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -60.94 -53.28 59.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -57.42 -41.26 80.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.67 0.271 . . . . 0.0 110.692 177.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.01 -44.89 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.592 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.2 m -58.74 -46.32 87.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.024 0.44 . . . . 0.0 110.34 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -76.12 -17.45 59.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.6 t -69.01 -47.83 64.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.835 177.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.8 mm? -86.47 -31.22 21.47 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -72.09 -22.88 61.28 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.04 -164.29 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -98.62 173.11 7.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.305 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.89 -47.23 39.89 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 114.659 0.623 . . . . 0.0 114.659 -169.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.9 mptt -60.9 -37.06 80.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 117.153 0.476 . . . . 0.0 110.967 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 30.6 mt-10 -81.61 -34.79 30.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.888 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.434 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 7.1 m120 -65.94 -23.9 66.7 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 9.2 tpp180 -86.92 -35.04 19.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.235 0.54 . . . . 0.0 109.694 172.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.836 HD22 HG12 ' A' ' 13' ' ' VAL . 29.8 tp -60.99 -36.39 79.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.333 -179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.639 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 21.6 p -65.72 -20.29 66.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.332 -178.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 45.7 m-85 -68.64 -30.94 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 97' ' ' ILE . 91.0 m-85 -85.3 -45.24 12.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.53 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.6 HD23 HD11 ' A' ' 97' ' ' ILE . 88.9 mt -68.7 -12.61 61.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.564 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 77.04 40.49 24.87 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.095 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -107.57 25.1 11.9 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.613 0.721 . . . . 0.0 110.281 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.1 t -149.03 141.76 24.54 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.295 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -80.04 -3.22 47.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 -174.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -92.88 7.95 41.73 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.16 -161.65 1.11 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.78 109.97 0.58 Allowed 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.443 0.464 . . . . 0.0 109.964 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -15.27 50.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.343 -173.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -66.5 -44.71 81.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.358 . . . . 0.0 110.568 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.859 HG23 ' HA3' ' A' ' 60' ' ' GLY . 16.7 tt -72.29 -21.52 20.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.756 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.1 tt -61.15 -46.9 88.63 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.485 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 8.6 m -66.36 -28.51 68.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.719 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 8.5 mm-40 -67.65 -58.26 4.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.708 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.587 ' O ' ' HB2' ' A' ' 77' ' ' MET . 60.9 t -62.32 -44.29 99.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.798 0.333 . . . . 0.0 111.6 -173.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.473 ' HA ' HG21 ' A' ' 37' ' ' ILE . 16.4 p -56.59 -32.56 65.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -176.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.485 ' HD3' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -61.32 -56.75 30.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.267 -175.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.942 ' HB2' ' HG2' ' A' ' 81' ' ' MET . 72.6 Cg_endo -78.77 -27.49 4.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 121.706 1.604 . . . . 0.0 113.444 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.587 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 0.3 OUTLIER -67.21 -19.21 65.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.801 0.334 . . . . 0.0 110.795 -178.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.8 t -68.34 -13.36 62.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.547 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.699 HG22 ' H ' ' A' ' 80' ' ' HIS . 5.9 p -129.23 179.25 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.699 ' H ' HG22 ' A' ' 79' ' ' VAL . 14.9 t-80 -55.02 -67.86 0.24 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 122.501 0.32 . . . . 0.0 110.226 -178.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.942 ' HG2' ' HB2' ' A' ' 76' ' ' PRO . 15.4 tpt 67.39 145.71 0.1 Allowed Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 164.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.863 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 42.5 Cg_exo -43.74 4.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.949 1 C-N-CA 127.661 5.574 . . . . 0.0 118.251 168.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.607 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.21 -31.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -158.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.83 ' SD ' ' HG3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.75 -45.18 83.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 120.028 1.285 . . . . 0.0 109.997 175.239 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.83 ' HG3' ' SD ' ' A' ' 84' ' ' MET . 90.1 mttt -63.82 -24.2 67.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.148 176.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.775 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 32.7 mt -61.76 -27.38 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.896 -174.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.722 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 18.6 t -75.59 -31.56 59.99 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.57 176.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 4.5 mm-40 -63.35 -43.24 98.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.185 173.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.775 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 0.0 OUTLIER -68.57 -33.94 74.95 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.415 176.084 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 15.5 mt -64.3 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.283 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 54.2 mtpt -67.33 -17.13 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.072 0.463 . . . . 0.0 110.854 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.423 ' HB3' ' O ' ' A' ' 89' ' ' LYS . 58.0 tttm -76.69 -25.53 53.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.772 175.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.65 -52.54 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.736 175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.662 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 11.7 t70 -139.49 134.19 31.93 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.051 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 m -85.71 -30.36 23.21 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -86.27 -14.82 42.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.6 HD11 HD23 ' A' ' 59' ' ' LEU . 14.5 tt -59.7 -27.61 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.027 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 45.4 t -83.12 -30.93 27.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.679 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.28 -94.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.398 -171.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.64 -68.28 0.12 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.544 0.528 . . . . 0.0 110.582 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp 64.24 117.32 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.668 0.747 . . . . 0.0 111.81 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.522 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 89.5 m-85 . . . . . 0 CA--C 1.518 -0.283 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.894 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.613 ' O ' ' HB3' ' A' ' 84' ' ' MET . 56.7 Cg_endo . . . . . 0 N--CA 1.443 -1.446 0 N-CA-C 110.184 -0.737 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -73.77 -27.8 66.33 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.119 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . 177.78 -125.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 O-C-N 124.028 0.487 . . . . 0.0 110.624 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -128.41 -63.56 0.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HB3' ' HA ' ' A' ' 99' ' ' GLU . 18.9 m -70.17 124.66 24.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.243 171.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 3.0 mp0 -46.28 -49.16 17.77 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -169.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.912 HG12 HD22 ' A' ' 55' ' ' LEU . 61.5 t -70.11 -46.81 71.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -167.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 12.7 p -66.47 -30.08 70.34 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.644 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 19.6 ttmt -61.27 -54.7 40.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.6 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.631 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 59.9 mm-40 -52.22 -52.29 53.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.081 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -58.8 -55.4 35.56 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.771 -176.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 87' ' ' CYS . 85.6 mt -63.07 -44.15 96.58 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.991 -172.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.544 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -65.61 -49.04 70.18 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 123.143 0.277 . . . . 0.0 111.538 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.631 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 10.5 mtm180 -71.33 -35.89 71.37 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.714 -175.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -64.18 -44.09 93.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.487 0.66 . . . . 0.0 109.497 174.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.521 ' O ' HG12 ' A' ' 26' ' ' ILE . 66.7 t80 -54.81 -55.54 29.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.377 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -70.73 -27.63 64.1 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.972 -178.089 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.477 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 51.4 m -63.37 -52.87 59.88 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.744 176.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.75 HD23 HD22 ' A' ' 31' ' ' ASN . 3.1 mp -60.69 -36.59 79.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.484 0.183 . . . . 0.0 111.38 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.4 mm -67.63 -52.53 39.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.72 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -70.83 -35.01 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.664 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.619 ' HB2' HG12 ' A' ' 30' ' ' VAL . 64.2 mtp180 -75.06 -14.49 60.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.021 0.439 . . . . 0.0 111.242 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.66 40.12 85.89 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.526 -0.629 . . . . 0.0 111.526 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.681 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 3.4 p -127.42 56.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-O 122.519 1.152 . . . . 0.0 110.13 -173.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.75 HD22 HD23 ' A' ' 25' ' ' LEU . 12.8 t-20 -143.68 -163.64 1.7 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.583 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.453 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 94.1 m-85 60.73 30.14 19.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.512 0.673 . . . . 0.0 110.879 -176.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.51 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 32.7 m -153.15 112.84 3.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.745 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.2 mm? -61.85 -41.28 97.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.34 -172.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.48 -27.29 64.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.153 0.501 . . . . 0.0 110.389 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.51 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.0 m -73.88 -45.97 47.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.747 178.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 33' ' ' SER . 45.0 mt -61.32 -34.3 60.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -73.41 -25.52 60.57 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.375 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -85.6 -44.86 12.26 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.063 0.458 . . . . 0.0 110.263 176.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -65.89 -35.77 81.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.596 -176.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.778 HD13 HD11 ' A' ' 70' ' ' LEU . 16.4 mt -55.96 -40.05 72.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.273 0.559 . . . . 0.0 109.645 172.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 51.4 mt -72.72 -38.39 58.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.397 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 t -75.25 -50.78 15.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.969 0.414 . . . . 0.0 110.73 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -62.83 -30.92 71.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.027 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 15.6 m -68.07 -27.85 66.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -89.18 -15.18 34.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.218 0.532 . . . . 0.0 110.507 173.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.32 -22.2 41.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.534 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.782 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -76.94 -168.18 1.01 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.813 179.231 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -93.84 167.97 11.29 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.32 -46.53 35.53 Favored Glycine 0 CA--C 1.517 0.197 0 O-C-N 123.662 0.601 . . . . 0.0 114.442 -171.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 100' ' ' LEU . 16.7 tppt? -59.35 -38.79 81.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 117.146 0.473 . . . . 0.0 110.33 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.782 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.5 mt-10 -80.37 -36.49 33.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.204 -176.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -59.28 -47.79 84.04 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 174.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -68.13 -37.5 81.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.48 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.912 HD22 HG12 ' A' ' 13' ' ' VAL . 33.8 tp -52.72 -38.6 61.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.088 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 68.5 m -71.87 -15.04 62.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -73.19 -23.11 60.37 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.497 ' HB3' HG13 ' A' ' 97' ' ' ILE . 89.4 m-85 -85.33 -46.7 10.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.55 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.859 ' HA ' HD11 ' A' ' 97' ' ' ILE . 86.9 mt -62.21 -24.66 67.36 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.702 -178.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.76 7.11 61.72 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.626 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.407 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -90.49 59.85 4.43 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.451 0.643 . . . . 0.0 110.822 -178.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.3 t -166.11 146.93 6.57 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.449 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -87.2 24.42 1.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.527 0.68 . . . . 0.0 110.445 -176.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -125.72 13.83 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.205 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -141.46 -176.0 4.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.721 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -73.89 88.78 1.84 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.965 0.412 . . . . 0.0 111.155 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -18.84 65.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.801 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -61.28 -21.72 64.2 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 66' ' ' ALA . 10.9 pt -85.44 -14.48 10.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.089 0.471 . . . . 0.0 110.48 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.778 HD11 HD13 ' A' ' 41' ' ' LEU . 21.8 tp -69.88 -15.42 63.07 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.876 -171.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.416 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 2.8 p -61.12 -29.66 69.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.535 174.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 58.6 mm-40 -63.47 -29.11 70.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.387 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.477 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.2 t -88.41 -56.79 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.192 0.52 . . . . 0.0 111.122 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 6.6 p -53.14 -47.83 68.39 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.283 -172.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.585 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.4 mpt_? -65.09 -51.78 52.91 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.7 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 45.9 Cg_exo -61.76 -34.96 81.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.549 1.499 . . . . 0.0 113.247 175.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 21.0 mmt -68.08 -13.55 62.29 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.2 t -67.7 -13.47 62.12 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -175.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.516 HG13 ' H ' ' A' ' 80' ' ' HIS . 2.8 p -134.77 -62.23 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.516 ' H ' HG13 ' A' ' 79' ' ' VAL . 12.7 t-80 -176.33 -89.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -173.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.7 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 49.5 mtp 68.11 167.56 0.12 Allowed Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 163.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 4.9 Cg_endo -44.92 4.02 0.01 OUTLIER 'Trans proline' 0 C--O 1.205 -1.151 1 C-N-CA 127.987 5.791 . . . . 0.0 117.969 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -34.6 -26.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -148.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.624 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -54.21 -42.98 70.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 120.471 1.487 . . . . 0.0 109.744 166.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.761 ' HB3' ' HB2' ' A' ' 82' ' ' PRO . 23.9 ttmm -71.1 -17.71 62.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.966 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 83' ' ' ALA . 66.9 mt -64.84 -25.39 37.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.414 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.6 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 51.0 t -80.32 -30.58 38.15 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.59 173.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.53 -40.65 93.19 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 8.1 tppt? -57.96 -47.51 82.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.74 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 97' ' ' ILE . 16.4 mt -65.67 -24.56 67.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.055 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.6 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 39.8 mtpt -69.99 -14.99 62.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.834 -177.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 34.9 pttt -73.94 -22.75 59.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.189 -0.605 . . . . 0.0 109.405 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -87.92 -45.88 9.87 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.913 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 10.5 t70 -142.46 138.02 30.72 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.689 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.2 m -87.02 -28.04 22.85 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -175.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -85.88 -14.23 45.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.114 0.483 . . . . 0.0 110.911 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.859 HD11 ' HA ' ' A' ' 59' ' ' LEU . 18.8 tt -55.02 -27.21 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.089 -175.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 14' ' ' CYS . 15.8 p -85.39 -38.88 18.21 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -169.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.677 ' HG3' ' H ' ' A' ' 100' ' ' LEU . 6.5 pt-20 -79.58 -98.43 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.121 -170.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.677 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 94.5 mt 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 117.841 0.292 . . . . 0.0 110.326 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -49.64 134.98 19.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.53 -174.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.0 110.556 -177.346 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo . . . . . 0 N--CA 1.444 -1.417 0 N-CA-C 111.317 -0.301 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.518 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -90.32 -32.46 9.56 Favored Glycine 0 N--CA 1.436 -1.301 0 C-N-CA 119.111 -1.519 . . . . 0.0 111.733 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -166.21 -81.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.892 0.377 . . . . 0.0 110.232 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -176.48 -47.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.825 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.7 p -66.21 -90.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.357 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 31.2 tt0 -172.45 -81.68 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.926 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -56.86 -45.08 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 111.488 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.5 t -64.69 -35.42 80.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.852 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 13.3 ptpt -71.82 -37.73 70.28 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.108 0.48 . . . . 0.0 109.717 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.582 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 78.2 mm-40 -58.82 -51.31 70.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.335 178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.38 -55.63 26.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.572 -176.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 86.5 mt -59.79 -43.19 94.54 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.62 0.248 . . . . 0.0 111.506 -174.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 14.4 t-20 -74.76 -44.01 51.9 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.865 -176.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 7.0 tpp85 -55.2 -51.2 67.32 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.271 0.557 . . . . 0.0 110.158 175.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CD2' ' SD ' ' A' ' 77' ' ' MET . 29.6 t80 -59.57 -42.63 92.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.659 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -52.96 -57.01 11.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.513 178.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -76.18 -30.94 58.26 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.755 -173.662 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 4.8 t -68.34 -36.73 79.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.937 0.399 . . . . 0.0 110.288 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -67.21 -42.95 83.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.43 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -63.69 -43.31 98.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.085 175.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -55.86 -55.53 31.38 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.085 0.469 . . . . 0.0 110.777 177.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.4 mtm-85 -66.78 -17.35 64.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.163 -177.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.51 31.52 33.32 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.583 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.733 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -131.04 100.69 4.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.074 -175.109 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -168.8 -170.58 1.2 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.9 t80 73.9 -49.57 0.68 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.784 0.834 . . . . 0.0 111.545 176.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 3.9 m -66.95 114.99 6.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.942 0.401 . . . . 0.0 110.317 177.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.693 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -58.39 -45.15 88.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.983 -176.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -28.52 69.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.266 0.555 . . . . 0.0 110.431 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.3 m -79.78 -45.49 18.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.524 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' SER . 37.4 mt -60.11 -27.93 40.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -64.12 -41.53 97.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.773 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 18.8 mmmt -74.22 -45.52 47.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.686 0.755 . . . . 0.0 109.981 -179.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.92 -33.45 75.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.743 -1.117 . . . . 0.0 111.769 -174.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 24.2 tp -59.8 -29.24 68.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.551 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 81.4 mt -84.48 -50.5 14.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.297 175.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -55.42 -37.93 68.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.981 -178.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -71.63 -33.81 69.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.721 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.551 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 26.6 p -85.41 -13.46 49.28 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 119.926 -0.709 . . . . 0.0 111.52 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.8 tp -86.58 -22.17 26.43 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 170.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -81.99 -23.22 36.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.041 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -79.89 -172.32 3.32 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.542 -175.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -99.23 173.85 6.59 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.853 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.14 -41.38 38.39 Favored Glycine 0 C--N 1.332 0.308 0 N-CA-C 114.993 0.757 . . . . 0.0 114.993 -169.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.9 tppt? -60.81 -43.54 98.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 0.0 109.955 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 19.1 mt-10 -80.45 -32.5 37.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.58 -174.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.63 -52.49 64.15 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -63.28 -35.63 81.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.486 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.926 HD22 HG12 ' A' ' 13' ' ' VAL . 52.1 tp -56.52 -33.57 66.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.029 177.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.793 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 51.3 t -70.67 -25.32 62.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.378 -177.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.531 ' CZ ' HG21 ' A' ' 62' ' ' THR . 64.3 m-85 -69.05 -28.14 66.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.207 0.527 . . . . 0.0 109.708 174.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.548 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.1 m-85 -86.83 -34.27 19.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.926 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.3 mt -71.51 -14.87 62.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.826 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.579 ' HA3' HD11 ' A' ' 69' ' ' ILE . . . 91.22 11.85 60.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.899 -0.667 . . . . 0.0 113.744 171.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.793 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -84.02 -43.29 15.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.006 0.403 . . . . 0.0 111.107 -178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.531 HG21 ' CZ ' ' A' ' 57' ' ' TYR . 1.2 m -64.65 154.41 36.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -178.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -80.3 49.18 1.09 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.901 0.381 . . . . 0.0 111.659 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.86 46.01 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.414 ' CB ' ' HA2' ' A' ' 60' ' ' GLY . . . -148.79 -167.77 2.92 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.169 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.9 123.17 21.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -76.34 -29.82 57.39 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -84.85 -29.75 25.05 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.579 HD11 ' HA3' ' A' ' 60' ' ' GLY . 24.2 pt -68.17 -16.89 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 120.758 0.313 . . . . 0.0 111.287 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 70' ' ' LEU . 3.0 tt -63.23 -37.98 89.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.9 m -68.39 -24.59 64.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.667 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.07 -24.93 65.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.009 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.499 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 59.0 t -87.57 -57.71 4.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 0.0 110.937 175.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.416 HG22 ' CG2' ' A' ' 37' ' ' ILE . 12.4 p -54.61 -54.97 34.48 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -173.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.693 ' HA ' HD11 ' A' ' 34' ' ' LEU . 9.3 mpt_? -54.4 -50.9 82.45 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 123.234 0.334 . . . . 0.0 111.867 -174.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.499 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 32.3 Cg_exo -64.96 -45.39 8.11 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 121.33 1.353 . . . . 0.0 112.707 173.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.429 ' SD ' ' CD2' ' A' ' 21' ' ' PHE . 53.5 ttm -65.25 -13.19 57.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.79 0.329 . . . . 0.0 111.812 -175.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.1 m -58.66 -19.25 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.726 175.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.465 HG13 ' HG2' ' A' ' 81' ' ' MET . 10.7 p -141.53 167.65 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 174.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -70.05 110.02 4.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.883 -0.51 . . . . 0.0 110.15 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.753 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 21.9 mmm -130.31 172.94 6.42 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -167.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.753 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.7 Cg_exo -39.19 1.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.824 1 C-N-CA 127.89 5.727 . . . . 0.0 118.68 171.032 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -39.83 -26.09 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -168.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.72 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.17 -41.3 79.0 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 122.129 0.966 . . . . 0.0 109.269 172.045 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 29.5 mtpt -85.26 -22.55 28.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.078 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.578 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 58.8 mt -66.93 -33.26 62.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 C-N-CA 120.399 -0.521 . . . . 0.0 109.878 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.497 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 34.6 t -62.63 -31.97 72.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.187 0.518 . . . . 0.0 110.299 173.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.661 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 33.8 tt0 -68.5 -34.82 76.56 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.684 177.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.213 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.28 -42.53 30.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.416 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.661 ' HG3' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -69.75 -13.77 62.45 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.819 0.342 . . . . 0.0 110.642 179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -59.72 -37.75 79.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.157 0.503 . . . . 0.0 109.744 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.0 -46.52 18.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.815 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.592 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 15.2 t70 -142.34 108.16 5.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.939 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . 0.615 ' HA ' ' HB2' ' A' ' 91' ' ' LYS . 13.0 t -73.48 -17.0 61.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.209 -175.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 23.8 mt-30 -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.64 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.548 HG12 ' HB3' ' A' ' 58' ' ' TYR . 84.0 mt -56.79 -48.84 80.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.575 0.702 . . . . 0.0 110.26 173.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.49 -48.87 13.15 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.814 -177.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -87.58 37.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.039 -176.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.656 HD23 HG11 ' A' ' 13' ' ' VAL . 21.3 tp -74.05 -57.18 4.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 65.13 122.45 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.207 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.47 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 96.6 m-85 . . . . . 0 CA--C 1.518 -0.287 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.269 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.452 -0.943 0 N-CA-C 110.621 -0.569 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.893 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -77.82 -34.72 37.76 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.283 -175.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -169.12 -92.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.931 0.396 . . . . 0.0 111.165 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -155.19 -47.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.259 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -76.12 -107.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 5.1 tp10 -153.84 -72.97 0.13 Allowed 'General case' 0 C--O 1.219 -0.5 0 O-C-N 122.105 -0.372 . . . . 0.0 111.457 -175.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 55' ' ' LEU . 77.7 t -57.75 -55.27 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.559 ' HA ' ' CD1' ' A' ' 55' ' ' LEU . 35.4 t -59.53 -35.44 74.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.479 0.657 . . . . 0.0 110.441 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.57 ' HG3' ' H ' ' A' ' 8' ' ' GLY . 6.3 ttmt -67.7 -46.52 72.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.755 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.593 ' HB3' HH21 ' A' ' 20' ' ' ARG . 26.0 mm-40 -57.41 -53.79 54.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.961 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -56.98 -55.37 35.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.246 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 69.8 mt -61.44 -55.35 32.29 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 120.533 0.206 . . . . 0.0 111.46 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.893 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 26.3 t-20 -66.47 -45.53 79.41 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 16' ' ' GLU . 18.6 ttp85 -67.3 -39.04 85.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.438 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -61.33 -46.15 91.47 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 122.308 1.052 . . . . 0.0 109.192 174.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.746 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.2 t80 -55.76 -38.08 69.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 112.864 -1.971 . . . . 0.0 111.974 -175.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.591 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -85.46 -28.98 24.67 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.476 178.023 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.591 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 69.0 m -59.9 -40.26 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.886 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.7 mp -69.66 -25.02 63.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.375 179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.0 mm -78.76 -51.61 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.97 -46.4 89.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.177 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.484 ' HB2' HG12 ' A' ' 30' ' ' VAL . 53.2 mtp85 -72.92 -13.64 61.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.009 -177.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.75 45.08 54.65 Favored Glycine 0 C--N 1.332 0.344 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.713 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 6.0 p -138.26 51.21 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 0 CA-C-O 122.378 1.085 . . . . 0.0 109.883 -170.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -130.82 179.96 5.66 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.593 -0.692 . . . . 0.0 111.345 -172.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.586 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 71.0 m-85 72.28 -48.14 0.68 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.978 0.911 . . . . 0.0 112.131 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 15.0 m -64.43 104.85 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.44 -41.34 72.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.854 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -63.32 -34.15 77.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.597 0.713 . . . . 0.0 110.197 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 85.9 m -79.71 -43.94 21.73 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.259 -178.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 33' ' ' SER . 67.5 mt -59.34 -31.74 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG3' HD21 ' A' ' 70' ' ' LEU . 35.2 tt0 -61.37 -55.13 34.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.812 175.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' HD12 ' A' ' 42' ' ' ILE . 21.9 tptm -67.13 -35.28 79.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.212 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.06 -34.59 73.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.196 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 41' ' ' LEU . 11.5 mt -61.01 -41.65 96.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 172.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 39' ' ' LYS . 99.0 mt -59.57 -48.67 86.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.735 175.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 t -63.76 -48.71 75.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.891 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.547 ' HZ ' ' HG2' ' A' ' 20' ' ' ARG . 11.3 t80 -63.95 -34.57 78.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.28 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -60.44 -33.25 72.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.632 176.868 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -86.87 -39.39 15.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.44 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.18 -15.66 60.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.931 -173.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.766 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.97 -171.17 0.83 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.865 0.364 . . . . 0.0 111.466 178.849 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.24 164.34 13.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.424 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -47.61 -41.47 18.73 Favored Glycine 0 C--N 1.331 0.253 0 O-C-N 123.661 0.601 . . . . 0.0 114.1 -171.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -61.05 -43.22 99.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.222 0.534 . . . . 0.0 110.569 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 21.0 mt-10 -79.04 -30.42 44.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.171 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -63.57 -18.89 64.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 40.6 mmt180 -86.61 -46.27 10.25 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.858 172.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.64 HD13 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -62.46 -25.13 67.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.775 -174.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.632 ' N ' HD23 ' A' ' 55' ' ' LEU . 25.7 p -72.66 -14.75 61.65 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.255 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.501 ' HA ' ' OG1' ' A' ' 62' ' ' THR . 66.9 m-85 -72.72 -33.72 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.173 0.511 . . . . 0.0 109.626 171.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.417 ' HD2' ' HA ' ' A' ' 55' ' ' LEU . 60.0 m-85 -85.58 -29.24 24.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.569 HD13 ' HG ' ' A' ' 55' ' ' LEU . 8.1 mp -80.23 -6.04 57.18 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.852 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.55 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 84.43 -0.8 89.24 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.233 176.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -80.07 42.54 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.148 0.499 . . . . 0.0 111.465 -177.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.501 ' OG1' ' HA ' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -145.17 133.3 21.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.899 -179.232 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.25 -7.7 52.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.74 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -90.5 -18.51 25.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.262 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.71 -160.75 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.377 -175.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.67 132.56 35.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.105 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 p -85.32 -18.09 34.88 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -77.96 -24.07 48.28 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.439 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' HA3' ' A' ' 60' ' ' GLY . 17.3 tt -85.09 -23.84 7.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.309 0.576 . . . . 0.0 109.653 173.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.494 HD21 ' HG3' ' A' ' 38' ' ' GLU . 41.1 tp -63.06 -42.7 99.75 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.094 175.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 p -69.17 -15.42 63.4 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.877 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.547 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 53.8 mm-40 -77.82 -56.67 4.31 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.672 177.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.45 -34.02 67.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-O 120.973 0.416 . . . . 0.0 111.748 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.417 HG22 HG22 ' A' ' 37' ' ' ILE . 7.6 p -57.33 -27.52 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -74.17 -54.49 3.36 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.861 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.547 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 23.9 Cg_endo -64.74 -17.73 60.4 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.653 1.569 . . . . 0.0 113.195 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.5 mmt -75.69 -16.53 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.473 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.586 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 34.1 t -86.19 -52.77 5.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.861 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.562 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.3 p -109.06 142.34 21.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.011 -176.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.746 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 72.5 m80 -57.15 111.37 1.04 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.844 0.354 . . . . 0.0 110.593 -177.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.562 ' HG3' HG13 ' A' ' 79' ' ' VAL . 32.1 mtp -140.8 170.08 10.24 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -168.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.437 ' C ' HG13 ' A' ' 86' ' ' ILE . 30.1 Cg_exo -41.0 0.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.828 1 C-N-CA 127.623 5.549 . . . . 0.0 118.093 171.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.469 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -38.17 -38.61 0.35 Allowed 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 120.195 1.361 . . . . 0.0 114.522 -169.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.4 OUTLIER -60.64 -38.17 83.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.891 -0.506 . . . . 0.0 110.766 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.499 ' N ' ' HG2' ' A' ' 84' ' ' MET . 51.6 mttm -86.25 -22.97 26.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.221 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.469 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 25.8 mt -62.17 -33.1 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.161 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.567 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 41.8 t -63.86 -36.1 82.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.167 0.508 . . . . 0.0 110.604 174.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.7 mt-10 -66.81 -39.14 87.6 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.703 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -62.38 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.678 175.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 93' ' ' LEU . 14.6 mt -60.28 -31.59 70.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.595 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 9.5 mtpm? -65.2 -19.31 65.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.25 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -23.93 50.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 109.789 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.7 mp -84.39 -52.84 5.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.745 175.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -144.16 132.48 21.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.982 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -85.1 -18.45 34.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -174.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.704 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 78.7 mt-30 -67.61 -33.18 74.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.569 0.223 . . . . 0.0 110.644 -178.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 63.5 mt -46.31 -48.96 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.14 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -34.93 15.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.685 -177.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.671 ' HA ' ' HE3' ' A' ' 101' ' ' LYS . 16.3 mm-40 -89.55 21.15 3.55 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -171.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.752 ' HB3' ' HG3' ' A' ' 51' ' ' LYS . 34.0 mt -67.72 -54.22 21.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.443 173.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.671 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 30.0 mmtp 70.18 139.71 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.753 0.787 . . . . 0.0 112.47 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.448 -1.189 0 N-CA-C 111.654 -0.171 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.646 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -77.46 -27.43 59.4 Favored Glycine 0 CA--C 1.507 -0.433 0 C-N-CA 119.316 -1.421 . . . . 0.0 112.088 -171.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 1.017 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -171.29 -97.77 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.756 0.312 . . . . 0.0 110.881 177.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -161.75 176.91 10.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 82.9 m 60.62 -85.57 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 123.213 0.605 . . . . 0.0 111.129 -175.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.796 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 37.0 tt0 -179.61 -76.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.925 HG12 HD22 ' A' ' 55' ' ' LEU . 90.6 t -60.4 -39.58 81.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -167.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 98' ' ' CYS . 5.7 p -70.98 -32.21 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.049 178.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.796 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.8 ptmt -73.81 -31.14 63.11 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -177.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.33 -51.81 64.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.147 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 44' ' ' PHE . 44.0 t80 -60.53 -53.19 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.041 -179.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.607 HD12 ' HB2' ' A' ' 9' ' ' ALA . 84.7 mt -58.82 -47.61 84.21 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.126 0.266 . . . . 0.0 111.549 -174.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.514 ' HB2' ' CA ' ' A' ' 8' ' ' GLY . 29.0 t-20 -60.2 -49.46 77.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.716 0.293 . . . . 0.0 111.181 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -61.12 -46.06 92.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.275 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -65.83 -47.65 74.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.172 0.511 . . . . 0.0 110.601 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.479 ' O ' HG12 ' A' ' 26' ' ' ILE . 64.1 t80 -51.33 -50.27 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.713 -178.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.531 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -78.52 -33.11 48.2 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.543 -176.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 8.4 t -62.68 -36.02 81.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 0.0 110.786 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.824 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.8 mp -72.91 -27.53 61.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.929 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -76.2 -32.97 23.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.51 -57.13 10.06 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.529 0.68 . . . . 0.0 110.502 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -75.23 -21.43 58.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.486 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.97 45.91 90.9 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.422 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 ' HG ' ' A' ' 25' ' ' LEU . 2.8 m -96.93 4.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.541 0.686 . . . . 0.0 111.461 -173.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.465 HD21 HD23 ' A' ' 25' ' ' LEU . 20.9 m120 -82.56 -171.32 3.42 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.972 -170.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 92.7 m-85 71.76 -34.9 0.31 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.502 0.721 . . . . 0.0 111.252 -176.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 16.6 m -88.09 103.02 15.35 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.6 mm? -59.09 -38.99 80.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.243 -176.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.4 -38.07 85.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.067 0.461 . . . . 0.0 110.674 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.506 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 23.0 m -73.7 -46.14 47.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.757 -178.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.436 HG22 HG22 ' A' ' 74' ' ' THR . 48.1 mt -59.97 -31.63 48.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.476 0.655 . . . . 0.0 109.281 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -70.09 -43.67 70.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.652 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HD3' ' C ' ' A' ' 39' ' ' LYS . 12.7 tmtt? -66.92 -42.06 86.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.076 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HG3' HG21 ' A' ' 30' ' ' VAL . 55.3 mm-40 -67.72 -33.51 75.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.486 -179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.611 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 13.1 mt -54.0 -51.75 62.95 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 170.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.69 -49.78 81.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -58.83 -48.76 80.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.504 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.403 ' HD2' ' CE2' ' A' ' 17' ' ' PHE . 14.7 t80 -67.33 -31.37 71.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.881 0.372 . . . . 0.0 110.187 -175.209 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 62.8 m -64.68 -37.91 89.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.64 177.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 46' ' ' LEU . 2.0 tm? -86.06 -36.46 19.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.131 0.491 . . . . 0.0 110.512 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.33 -22.16 66.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.0 -175.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.764 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -76.76 -169.44 1.27 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.635 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -97.82 175.74 6.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.645 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.91 -40.94 35.74 Favored Glycine 0 CA--C 1.518 0.276 0 O-C-N 123.621 0.576 . . . . 0.0 114.463 -170.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 102' ' ' TYR . 0.2 OUTLIER -62.2 -50.85 70.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.07 0.435 . . . . 0.0 110.484 -179.648 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.764 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 1.6 mp0 -71.75 -34.23 69.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.621 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -57.44 -45.6 84.5 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -71.61 -37.61 70.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.39 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.925 HD22 HG12 ' A' ' 13' ' ' VAL . 22.9 tp -53.75 -32.59 52.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.555 178.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 32.6 t -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -176.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.49 -29.76 62.7 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.572 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.458 ' HB3' HG13 ' A' ' 97' ' ' ILE . 87.7 m-85 -74.68 -44.59 49.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.406 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.697 HD23 HD11 ' A' ' 97' ' ' ILE . 77.6 mt -67.28 -27.77 67.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.012 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.433 ' HA3' HG21 ' A' ' 69' ' ' ILE . . . 91.56 -9.65 76.61 Favored Glycine 0 C--O 1.225 -0.462 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.756 172.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.648 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -67.14 -16.16 64.15 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.159 0.48 . . . . 0.0 112.264 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -72.04 138.72 48.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -74.52 47.34 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.24 0.543 . . . . 0.0 111.552 -176.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -132.4 -32.3 1.35 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.516 178.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.12 -161.23 0.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.622 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 69' ' ' ILE . . . -63.32 140.17 58.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 174.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' HD13 ' A' ' 70' ' ' LEU . 33.3 p -85.74 -24.49 26.88 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -69.13 -30.05 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.39 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 66' ' ' ALA . 19.5 tt -66.71 -22.6 29.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.779 0.323 . . . . 0.0 110.654 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' A' ' 67' ' ' THR . 10.3 mp -61.02 -53.26 59.45 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.64 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 4.4 p -65.92 -34.02 77.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.544 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -58.65 -31.15 67.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.646 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.28 -46.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.991 0.424 . . . . 0.0 110.649 175.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.64 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 46.5 p -59.47 -36.04 75.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 71' ' ' SER . 1.5 mpp_? -58.93 -55.81 42.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.214 -178.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.61 -39.75 20.11 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.266 1.311 . . . . 0.0 112.421 175.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.1 mmt -60.27 -19.5 55.08 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.3 t -62.3 -14.97 44.74 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.553 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -151.47 175.75 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -176.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.553 ' H ' HG22 ' A' ' 79' ' ' VAL . 12.8 m-70 -64.43 122.44 16.75 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.47 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 43.0 mmm -140.71 167.9 16.18 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -170.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 76.3 Cg_exo -46.46 0.4 0.02 OUTLIER 'Trans proline' 0 C--O 1.208 -1.016 1 C-N-CA 126.966 5.11 . . . . 0.0 117.3 176.09 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.574 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -35.9 -40.18 0.18 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 -156.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 1.017 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.21 -36.17 68.13 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.672 0.669 . . . . 0.0 110.826 174.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 19.1 mtpp -85.12 -20.43 30.33 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.369 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 32.7 mt -64.42 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.516 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.695 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 51.6 t -66.42 -22.2 66.22 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.743 177.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.2 mt-10 -75.74 -37.98 58.88 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.592 175.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.59 -30.82 71.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.031 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' CYS . 93.4 mt -70.09 -14.97 62.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.247 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 30.7 mtpp -67.81 -17.55 64.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.701 0.286 . . . . 0.0 110.645 178.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -69.51 -28.14 65.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 0.0 109.896 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.0 mp -88.58 -48.7 7.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.581 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 8.8 t70 -146.44 126.23 13.5 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.9 m -78.21 -26.21 47.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.68 0.276 . . . . 0.0 111.517 -174.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.4 -12.57 51.75 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.598 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.697 HD11 HD23 ' A' ' 59' ' ' LEU . 17.7 tt -48.35 -34.05 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.595 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 30.5 p -82.36 -28.45 31.54 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.102 -176.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -79.18 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.422 -171.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 8.5 mp 64.48 -62.07 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.365 0.666 . . . . 0.0 111.475 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 69.8 mmtt 69.47 129.0 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.39 0.676 . . . . 0.0 111.141 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.462 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 80.4 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.049 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.45 -1.051 0 CA-C-O 121.157 0.399 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.632 ' HA3' ' HA ' ' A' ' 15' ' ' LYS . . . -71.92 -23.96 77.26 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.587 -0.816 . . . . 0.0 111.801 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -167.34 -93.95 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 120.714 0.292 . . . . 0.0 111.565 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -164.16 -32.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.793 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.84 -90.09 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.232 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 43.3 tt0 -170.81 -76.73 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.767 HG12 HD22 ' A' ' 55' ' ' LEU . 26.4 t -60.32 -46.13 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 111.11 -173.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.62 ' HA ' HD21 ' A' ' 55' ' ' LEU . 45.6 t -63.98 -28.89 70.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.374 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.632 ' HA ' ' HA3' ' A' ' 8' ' ' GLY . 55.1 mtpt -65.1 -50.46 66.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.596 0.712 . . . . 0.0 109.608 174.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.5 mm-40 -54.51 -55.15 32.08 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.371 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.452 ' HB2' HD23 ' A' ' 55' ' ' LEU . 24.4 t80 -58.28 -55.67 31.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.637 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.489 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 92.4 mt -61.98 -48.05 82.1 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -173.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.6 -42.85 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.258 0.551 . . . . 0.0 110.686 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -70.74 -36.84 73.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.203 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -59.36 -45.86 90.25 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.544 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -52.68 -56.79 12.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.451 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -25.12 63.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.791 -175.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.574 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 74.4 m -67.76 -56.02 10.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.864 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.646 HD12 HG22 ' A' ' 30' ' ' VAL . 3.9 mm? -61.01 -39.02 88.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.275 -177.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' TYR . 47.4 mm -65.83 -37.29 79.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.867 0.365 . . . . 0.0 110.81 177.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.84 -45.0 65.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.777 ' HG3' HG13 ' A' ' 30' ' ' VAL . 2.8 ptm180 -74.69 -13.6 60.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.905 0.383 . . . . 0.0 111.34 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.52 32.89 14.68 Favored Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.403 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.777 HG13 ' HG3' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -142.37 112.54 2.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -178.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.838 ' HA ' HD11 ' A' ' 37' ' ' ILE . 0.2 OUTLIER -169.12 15.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -179.282 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -125.06 13.68 8.41 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 -174.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.633 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 49.4 m -122.32 124.47 43.8 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.6 mm? -68.91 -38.62 79.69 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.45 -15.64 60.41 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.414 0.626 . . . . 0.0 109.79 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.633 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 37.8 m -84.06 -48.2 10.15 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.943 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.838 HD11 ' HA ' ' A' ' 31' ' ' ASN . 33.7 mm -59.44 -29.74 42.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.51 -43.31 93.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.782 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 14.5 mmmm -83.71 -34.62 24.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.121 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' HD11 ' A' ' 25' ' ' LEU . 11.2 mm-40 -66.39 -33.88 76.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.3 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.76 -34.09 72.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.114 0.483 . . . . 0.0 109.845 171.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.643 HG12 ' HA ' ' A' ' 62' ' ' THR . 80.9 mt -73.11 -51.6 25.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.232 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.9 t -58.78 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.755 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -65.57 -35.57 81.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.017 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 25.9 t -65.07 -33.34 75.8 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.87 177.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.6 tp -87.07 -15.93 37.09 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.187 0.518 . . . . 0.0 111.05 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -90.48 -14.96 31.71 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.937 -175.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -92.37 -169.91 2.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.548 -173.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -94.82 173.62 7.51 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.875 177.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.44 -49.17 33.13 Favored Glycine 0 C--N 1.33 0.242 0 O-C-N 123.821 0.701 . . . . 0.0 114.651 -168.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.783 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 12.6 mptt -61.98 -41.29 97.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.216 0.508 . . . . 0.0 111.127 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 13.8 mm-40 -68.58 -40.47 80.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.195 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -59.28 -36.52 75.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.48 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -77.62 -37.85 49.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.647 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.767 HD22 HG12 ' A' ' 13' ' ' VAL . 53.3 tp -63.48 -29.5 70.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.154 -174.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 13.4 p -63.59 -27.33 69.17 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.771 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.71 -30.65 71.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 0.0 110.186 175.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 97' ' ' ILE . 85.1 m-85 -86.48 -22.59 26.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.683 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' HG21 ' A' ' 73' ' ' VAL . 87.3 mt -106.19 29.63 6.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.861 0.362 . . . . 0.0 111.772 -175.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.582 ' O ' ' HG ' ' A' ' 70' ' ' LEU . . . 63.15 62.97 4.92 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 113.504 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.6 177.62 7.68 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.643 ' HA ' HG12 ' A' ' 42' ' ' ILE . 42.9 p 62.9 148.12 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.492 1.117 . . . . 0.0 112.31 -179.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -84.68 56.43 3.86 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.624 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -163.19 -35.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.165 -175.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.78 -170.42 2.98 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.29 101.85 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.882 0.739 . . . . 0.0 111.056 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -15.42 41.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.262 -169.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -79.35 -46.38 17.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.8 pt -69.8 -14.27 18.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.613 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.2 tt -55.64 -42.8 75.51 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.766 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.608 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 10.8 p -74.23 -28.16 61.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.92 -22.75 62.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.443 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 59' ' ' LEU . 61.7 t -88.07 -55.31 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.044 172.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.479 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 10.6 p -56.06 -43.45 77.92 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 34' ' ' LEU . 11.5 mpt_? -62.36 -53.02 61.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.35 -177.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 53.2 Cg_exo -57.94 -38.81 90.79 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.742 1.628 . . . . 0.0 112.803 172.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.5 mmt -58.75 -25.12 62.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.637 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.2 t -63.12 -14.03 43.63 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.574 HG22 ' H ' ' A' ' 80' ' ' HIS . 9.7 p -149.79 175.01 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.574 ' H ' HG22 ' A' ' 79' ' ' VAL . 28.1 m80 -72.62 109.04 5.98 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.783 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 23.7 mmm -125.56 166.9 18.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 121.936 0.874 . . . . 0.0 113.179 -170.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.783 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.1 Cg_exo -39.89 2.95 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.951 1 C-N-CA 128.211 5.94 . . . . 0.0 118.339 169.525 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.555 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -39.17 -32.78 0.11 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -164.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.601 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.3 OUTLIER -61.87 -35.32 77.95 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.388 0.995 . . . . 0.0 110.397 176.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 16.1 ptpt -86.43 -19.59 29.41 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 1.014 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 37.7 mt -61.63 -41.72 91.4 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.327 -179.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.524 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 49.1 t -70.36 -22.32 62.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.322 0.582 . . . . 0.0 110.641 176.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.54 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 17.4 mm-40 -70.13 -26.25 63.86 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 1.014 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 8.5 mtmp? -81.53 -28.99 33.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.494 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.567 ' HA ' HD13 ' A' ' 93' ' ' LEU . 2.8 mm? -63.57 -29.2 70.49 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.474 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 45.2 mttp -55.24 -26.76 41.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.06 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -75.5 -15.55 60.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.567 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.5 mp -91.2 -52.98 4.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.452 176.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.563 ' HB3' HG13 ' A' ' 97' ' ' ILE . 25.6 t70 -158.65 138.7 12.19 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.834 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 43.0 m -85.22 -24.63 27.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.191 -176.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.436 ' HB3' ' OD2' ' A' ' 94' ' ' ASP . 8.1 tt0 -70.37 -22.23 62.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.299 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 94' ' ' ASP . 36.3 mt -52.69 -45.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.717 0.77 . . . . 0.0 109.733 172.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 -47.27 9.09 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.972 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.22 42.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.476 HD23 HG11 ' A' ' 13' ' ' VAL . 18.4 tp -70.35 -53.91 14.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.836 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt 69.4 121.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.602 0.715 . . . . 0.0 112.003 176.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.783 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.4 m-85 . . . . . 0 CA--C 1.52 -0.209 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.023 178.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . 13.9 Cg_exo . . . . . 0 CA--C 1.53 0.313 0 CA-C-O 121.162 0.401 . . . . 0.0 111.622 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -98.62 -30.14 7.01 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.577 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . 164.38 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 123.907 0.883 . . . . 0.0 109.855 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -110.86 -19.05 12.95 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.95 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 62.3 m -71.28 -0.99 11.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.902 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.858 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 36.5 tt0 72.85 -65.84 0.34 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 114.892 -1.049 . . . . 0.0 113.626 166.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.905 HG12 HD22 ' A' ' 55' ' ' LEU . 57.6 t -62.61 -42.67 96.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.031 -176.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 29.9 p -74.74 -18.56 60.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.384 175.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 9.6 ptmt -72.1 -38.16 69.4 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -67.74 -51.82 44.79 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.561 175.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -58.09 -54.94 41.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.552 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.9 mt -65.83 -32.75 74.45 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 121.33 -0.148 . . . . 0.0 111.208 -175.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.449 ' ND2' ' HD2' ' A' ' 7' ' ' PRO . 3.0 t-20 -71.58 -53.95 12.05 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.069 -0.253 . . . . 0.0 110.909 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 68.9 mtp180 -53.16 -51.0 63.42 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.047 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.77 -50.61 72.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.789 -179.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.653 ' O ' HG12 ' A' ' 26' ' ' ILE . 26.3 t80 -54.45 -55.63 26.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.867 -178.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 23' ' ' LYS . 20.2 mmtt -69.9 -38.28 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -175.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.7 t -64.31 -27.87 69.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 0.0 110.46 179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.82 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 1.4 tp -82.08 -36.31 27.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.31 -176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 22' ' ' TYR . 44.6 mm -65.41 -49.1 80.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.141 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.0 -42.05 90.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.673 -176.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.539 ' HB2' HG12 ' A' ' 30' ' ' VAL . 81.5 mtm180 -77.34 -12.52 59.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.813 0.34 . . . . 0.0 111.729 -177.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.48 39.61 56.21 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.579 HG13 ' HA ' ' A' ' 25' ' ' LEU . 2.2 p -126.09 27.73 2.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 122.921 1.343 . . . . 0.0 109.444 -170.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.82 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 3.6 t-20 -131.92 99.84 4.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.216 -174.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 3.7 t80 166.13 -28.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.627 1.205 . . . . 0.0 108.507 174.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -82.57 120.85 26.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.219 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -59.29 -38.58 80.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.619 -175.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.52 -25.67 50.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.005 0.431 . . . . 0.0 110.618 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.447 HG21 HG23 ' A' ' 30' ' ' VAL . 29.7 m -77.69 -44.72 27.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.895 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.468 HD11 ' HA ' ' A' ' 78' ' ' SER . 66.0 mt -61.2 -29.78 46.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.228 0.537 . . . . 0.0 109.688 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -63.1 -54.2 41.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.06 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.2 -41.8 99.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.27 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -69.77 -37.56 76.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.816 -176.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.582 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 25.4 mt -57.12 -43.9 82.8 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 172.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.69 -48.48 88.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.453 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.1 m -69.81 -41.67 74.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.772 0.32 . . . . 0.0 111.845 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.509 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 19.2 t80 -67.47 -34.15 76.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.08 0.467 . . . . 0.0 110.349 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 21.2 m -60.97 -29.88 69.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.664 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 tp -88.3 -26.34 22.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.022 0.439 . . . . 0.0 111.273 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -82.22 -19.09 40.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.423 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -74.61 -173.34 1.77 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.871 -178.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.8 173.34 7.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.909 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.82 -44.33 55.23 Favored Glycine 0 CA--C 1.518 0.273 0 O-C-N 123.502 0.501 . . . . 0.0 114.24 -170.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -59.78 -38.58 82.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.208 0.504 . . . . 0.0 110.667 178.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.5 mt-10 -83.28 -37.51 23.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.936 -175.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -58.04 -45.86 86.29 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' ' CD2' ' A' ' 57' ' ' TYR . 40.9 tpt85 -76.43 -30.72 57.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.383 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.905 HD22 HG12 ' A' ' 13' ' ' VAL . 14.9 tp -58.5 -31.0 67.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.002 176.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.667 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 33.9 t -57.36 -30.12 64.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.644 -177.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.422 ' CD2' ' HD2' ' A' ' 54' ' ' ARG . 90.3 m-85 -65.73 -16.72 64.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.971 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.422 ' HB3' HG12 ' A' ' 97' ' ' ILE . 87.5 m-85 -86.28 -48.81 8.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.006 0.432 . . . . 0.0 110.583 175.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 78.6 mt -75.26 -17.35 60.33 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.055 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.516 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 98.92 -108.58 3.61 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -176.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.667 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . 50.57 21.82 0.95 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 172.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -140.48 150.99 44.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.139 -178.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -90.54 47.25 1.41 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -151.41 -52.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.921 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.59 104.0 14.85 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.867 -175.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.725 ' O ' HG22 ' A' ' 69' ' ' ILE . . . 49.42 61.19 3.27 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.895 0.747 . . . . 0.0 110.719 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 70' ' ' LEU . 1.0 OUTLIER -61.04 -18.28 56.93 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -167.637 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 23.3 ttpp -66.49 -27.83 68.09 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.052 -0.405 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 66' ' ' ALA . 20.4 tt -68.77 -21.82 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -61.28 -46.12 91.66 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 174.724 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.1 m -69.0 -30.64 69.08 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 65.4 mm-40 -66.62 -58.08 5.9 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.372 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.608 ' O ' ' HB2' ' A' ' 77' ' ' MET . 61.4 t -60.76 -44.77 98.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.401 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.9 p -52.92 -35.33 58.23 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -176.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HD3' ' O ' ' A' ' 71' ' ' SER . 7.1 mpt_? -63.95 -56.08 27.6 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.487 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.531 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 37.8 Cg_endo -70.63 -26.78 23.12 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 121.212 1.275 . . . . 0.0 112.044 173.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 1.6 tpt -67.0 -19.81 65.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 0.0 110.677 -179.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.468 ' HA ' HD11 ' A' ' 37' ' ' ILE . 67.6 m -73.04 -12.85 61.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.704 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.428 HG13 ' HG2' ' A' ' 81' ' ' MET . 2.8 p -130.92 148.87 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.5 m170 -55.42 109.7 0.59 Allowed 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 26.9 mmm -132.6 164.05 46.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -165.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.778 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 32.9 Cg_exo -40.37 3.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.768 1 C-N-CA 128.415 6.076 . . . . 0.0 118.333 169.36 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.541 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.97 -32.83 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.982 2.215 . . . . 0.0 116.982 -159.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.725 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -60.32 -39.49 87.22 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.933 1.242 . . . . 0.0 110.35 173.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 38.2 ttpt -80.56 -14.5 58.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.089 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.541 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 47.5 mt -72.02 -42.79 68.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 46.8 t -69.71 -31.11 68.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.201 0.524 . . . . 0.0 109.607 173.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.441 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 12.0 tp10 -57.42 -48.76 78.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.234 172.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 64.7 mttt -64.9 -29.17 70.1 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 177.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.1 mt -65.56 -14.45 61.12 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.082 -178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.551 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 56.8 mtpt -66.4 -20.33 66.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.58 177.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.426 ' HB3' ' NZ ' ' A' ' 92' ' ' LYS . 3.7 mmmp? -73.16 -21.49 60.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.935 176.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.3 -46.84 5.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.925 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -142.51 119.59 11.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.411 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.4 m -86.74 -13.65 44.68 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.621 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -78.43 -24.77 45.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.708 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.422 HG12 ' HB3' ' A' ' 58' ' ' TYR . 65.4 mt -47.08 -43.26 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.353 179.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.95 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 55.7 m -77.1 -15.67 59.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -168.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.84 39.35 3.54 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.658 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.528 ' HB3' HG21 ' A' ' 13' ' ' VAL . 5.6 mp -74.82 -58.61 3.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 168.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt 68.0 132.95 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.834 0.826 . . . . 0.0 112.815 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.625 ' CE2' ' HA ' ' A' ' 13' ' ' VAL . 93.2 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.853 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo . . . . . 0 N--CA 1.448 -1.19 0 N-CA-C 111.413 -0.264 . . . . 0.0 111.413 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.607 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -71.26 -34.08 64.36 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.527 -169.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.832 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.52 -90.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.626 0.251 . . . . 0.0 111.16 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -159.32 -73.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.062 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 98' ' ' CYS . 0.6 OUTLIER -84.09 73.28 10.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.657 0.742 . . . . 0.0 112.536 -176.118 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 42.2 mt-10 52.18 -104.17 0.18 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 167.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.523 HG12 HD12 ' A' ' 55' ' ' LEU . 19.0 t -50.17 -51.16 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -161.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.6 t -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.332 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.832 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 7.6 ptpt -72.05 -38.83 69.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 109.913 -178.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.59 -43.51 98.73 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.506 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -62.62 -55.86 23.18 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.366 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.4 mt -62.65 -41.69 99.19 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 121.099 -0.241 . . . . 0.0 111.194 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 2.8 t-20 -62.27 -55.75 25.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.508 0.195 . . . . 0.0 111.399 -176.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.19 -39.12 91.64 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE1' ' HA ' ' A' ' 41' ' ' LEU . 81.3 t80 -65.91 -49.73 66.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.242 0.544 . . . . 0.0 110.648 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.696 ' HE2' ' H ' ' A' ' 81' ' ' MET . 67.7 t80 -54.39 -37.18 64.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.629 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.7 mmmt -81.06 -47.05 14.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.326 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -56.11 -33.57 65.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.194 -176.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.766 ' HG ' HG23 ' A' ' 30' ' ' VAL . 2.4 tp -73.65 -33.2 64.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.941 0.4 . . . . 0.0 110.531 -176.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 22' ' ' TYR . 25.1 mm -79.99 -34.99 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.5 -43.3 99.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.685 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -71.72 -21.09 61.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.91 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.28 22.72 43.31 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.993 -0.623 . . . . 0.0 111.814 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.766 HG23 ' HG ' ' A' ' 25' ' ' LEU . 32.6 m -105.48 -136.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 CA-C-N 115.095 -0.552 . . . . 0.0 109.802 -177.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.505 HD22 HG12 ' A' ' 37' ' ' ILE . 2.5 t-20 74.1 -177.89 0.17 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.374 0.67 . . . . 0.0 111.444 175.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.437 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 53.1 t80 73.87 -57.12 0.63 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.136 0.974 . . . . 0.0 111.453 -177.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.583 ' O ' HG13 ' A' ' 37' ' ' ILE . 4.1 m -67.39 114.32 5.98 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -55.03 -41.12 70.97 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.801 -177.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -39.14 92.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.477 0.656 . . . . 0.0 110.144 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 22.1 m -74.1 -41.67 61.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.5 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.587 HG22 HG22 ' A' ' 74' ' ' THR . 61.5 mt -59.39 -33.96 52.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.83 -54.05 26.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.892 177.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -56.92 -52.88 63.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.152 -177.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.578 ' OE2' HG21 ' A' ' 30' ' ' VAL . 11.3 mt-10 -74.62 -20.76 59.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.805 -175.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.629 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 42.5 tp -63.4 -45.56 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.51 -46.9 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.317 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.483 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 58.4 m -55.34 -52.1 64.6 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.461 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -63.82 -44.92 91.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.373 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 8.1 t -64.42 -43.68 93.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.4 mm? -78.44 -14.31 59.43 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.002 0.429 . . . . 0.0 111.003 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.4 -23.03 40.68 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.572 177.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -74.3 -165.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.797 179.033 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -93.91 170.31 9.65 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.385 -0.197 . . . . 0.0 111.268 -176.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.78 -45.04 61.09 Favored Glycine 0 C--N 1.329 0.188 0 CA-C-N 115.889 -0.596 . . . . 0.0 114.565 -168.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tppt? -59.07 -41.68 88.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.444 0.64 . . . . 0.0 110.328 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.533 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 18.1 mt-10 -77.41 -34.7 54.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.263 -177.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -62.29 -50.41 71.77 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 13.7 tpt180 -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.102 -0.953 . . . . 0.0 111.18 -177.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -52.02 -37.96 55.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.84 -179.592 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.788 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 82.0 m -72.19 -14.48 61.81 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.426 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 63.2 m-85 -68.56 -34.34 75.65 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.581 ' HB3' HG12 ' A' ' 97' ' ' ILE . 28.2 m-85 -87.27 -42.3 13.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.422 176.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' A' ' 55' ' ' LEU . 31.0 mt -60.95 -34.43 74.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.365 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.652 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 103.65 -7.01 49.45 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.956 -178.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -76.23 48.2 0.5 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.365 0.602 . . . . 0.0 111.488 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.5 m -155.2 120.67 4.99 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -80.97 41.21 0.57 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.324 0.583 . . . . 0.0 111.091 -175.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -130.43 -6.76 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.268 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.84 -152.43 0.5 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.674 -175.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.41 125.17 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.947 0.403 . . . . 0.0 110.321 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.0 p -80.35 -33.54 37.26 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.066 -172.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.515 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 52.8 tttp -66.9 -42.74 84.97 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.368 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.652 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.0 tt -64.68 -28.39 44.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.814 0.34 . . . . 0.0 110.937 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tt -61.06 -47.8 84.67 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 172.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.525 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.7 m -64.51 -34.67 78.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.463 177.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 51.7 mm-40 -62.77 -23.87 67.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.259 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' MET . 59.8 t -87.66 -56.07 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.205 0.526 . . . . 0.0 110.713 172.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.587 HG22 HG22 ' A' ' 37' ' ' ILE . 20.7 p -59.22 -37.04 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -172.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.525 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.6 mpt_? -64.53 -54.82 34.17 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.581 -176.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -62.09 -35.16 77.45 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.224 1.283 . . . . 0.0 111.462 173.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.521 ' HB3' HG21 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -62.5 -13.31 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.898 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.498 ' HA ' HD11 ' A' ' 37' ' ' ILE . 29.2 t -62.14 -26.33 68.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.212 0.53 . . . . 0.0 110.476 177.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 8.4 p -123.57 152.9 28.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -58.11 120.34 8.43 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 1.4 mmt -125.5 149.85 66.05 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -161.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 66.7 Cg_exo -43.88 2.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.479 0.668 1 C-N-CA 127.27 5.314 . . . . 0.0 116.406 165.04 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.514 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.98 -22.5 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -158.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.607 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -48.13 -40.6 24.14 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 118.538 0.608 . . . . 0.0 110.223 164.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -87.22 -23.43 24.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 60.3 mt -64.36 -33.9 65.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.96 0.409 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 49.0 t -64.71 -30.16 71.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.4 0.619 . . . . 0.0 110.528 176.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -73.26 -32.9 64.96 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.927 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.64 -40.54 92.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.38 0.609 . . . . 0.0 109.7 173.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.581 ' HA ' HD13 ' A' ' 93' ' ' LEU . 94.4 mt -69.14 -17.67 63.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.384 -178.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.56 ' HD3' ' SG ' ' A' ' 98' ' ' CYS . 13.9 mmmm -65.26 -21.9 66.79 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.953 0.406 . . . . 0.0 110.664 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -77.45 -27.31 52.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.171 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.581 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.2 mp -83.43 -45.8 13.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.838 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.647 ' HB3' HG13 ' A' ' 97' ' ' ILE . 10.7 t70 -154.09 129.82 10.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.55 177.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.3 t -82.47 -35.61 27.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.019 -176.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.496 ' HA ' ' HB2' ' A' ' 99' ' ' GLU . 27.2 tt0 -69.94 -12.9 61.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.253 -174.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.647 HG13 ' HB3' ' A' ' 94' ' ' ASP . 38.2 mt -43.76 -55.17 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.601 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.58 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 26.6 p -91.94 -19.13 22.76 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.669 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 96' ' ' GLN . 42.8 mt-10 -88.71 17.32 5.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.372 -175.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.58 HD12 ' HG ' ' A' ' 55' ' ' LEU . 74.7 mt -62.26 -42.37 99.27 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 99' ' ' GLU . 56.4 mmtt 68.76 141.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.084 0.865 . . . . 0.0 111.605 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.959 176.777 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 84' ' ' MET . 2.0 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 CA-C-O 121.221 0.426 . . . . 0.0 111.351 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.929 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -90.46 -35.5 7.39 Favored Glycine 0 N--CA 1.441 -1.022 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.456 -173.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 173.26 -149.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -123.39 -24.44 4.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.483 0.658 . . . . 0.0 109.81 178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.65 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 21.2 m -76.55 1.02 17.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.832 -175.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' CA ' ' HB3' ' A' ' 15' ' ' LYS . 26.4 tp10 69.55 -74.3 0.08 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.942 171.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.684 ' HB ' ' O ' ' A' ' 101' ' ' LYS . 6.6 p -57.83 -46.77 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-O 121.639 0.733 . . . . 0.0 109.727 178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' HD21 ' A' ' 55' ' ' LEU . 8.4 t -68.45 -31.67 71.14 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.302 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.593 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 9.9 ttmt -59.24 -53.25 60.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.332 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.602 ' HG3' ' OH ' ' A' ' 102' ' ' TYR . 22.4 mm-40 -55.21 -49.98 70.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.057 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -62.02 -55.04 33.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.576 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 85.7 mt -56.7 -53.84 53.1 Favored 'General case' 0 C--O 1.223 -0.295 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -173.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.929 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.3 t-20 -67.44 -40.09 85.41 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.397 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.586 HH22 HG22 ' A' ' 48' ' ' THR . 35.6 mtp180 -65.03 -43.34 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.588 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.529 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 55.0 t80 -64.37 -47.27 79.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.3 0.572 . . . . 0.0 109.829 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -51.57 -42.17 61.67 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.648 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.5 mmmt -84.09 -37.76 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.508 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -60.5 -32.27 71.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.156 -178.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 22.9 mt -70.56 -27.92 64.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.022 0.439 . . . . 0.0 110.77 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 27.9 mm -80.18 -48.68 19.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.38 -44.91 95.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.452 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.434 ' HB2' HG12 ' A' ' 30' ' ' VAL . 62.8 mtp180 -79.43 -13.79 59.36 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.09 28.76 59.81 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.046 178.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.48 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.4 p -124.23 92.97 2.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.171 0.51 . . . . 0.0 109.858 -175.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -158.87 178.62 9.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.855 -174.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 78' ' ' SER . 25.6 t80 75.91 -55.39 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.462 1.105 . . . . 0.0 112.301 175.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.725 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 8.6 m -60.79 118.39 6.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.083 0.468 . . . . 0.0 110.91 -177.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.27 -41.72 89.52 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.578 -174.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.61 -26.14 60.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 18.7 m -74.77 -45.49 43.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.302 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.616 HG21 ' HA ' ' A' ' 74' ' ' THR . 21.9 mm -58.45 -34.29 50.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.41 -52.18 59.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.75 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.746 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -57.42 -37.31 72.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.775 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.48 ' HG3' HG21 ' A' ' 30' ' ' VAL . 59.1 mm-40 -85.13 -28.63 25.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.849 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.44 -42.5 92.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.1 mt -61.48 -52.19 64.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.843 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -65.04 -44.71 88.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.955 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -70.84 -27.02 63.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.47 . . . . 0.0 110.287 -176.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.5 t -62.95 -25.66 68.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.981 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -85.83 -37.5 19.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.47 56.41 3.57 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.563 0.697 . . . . 0.0 110.365 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.788 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -153.99 -173.4 4.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.487 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -97.35 171.89 8.12 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.416 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.21 29.9 Favored Glycine 0 C--N 1.331 0.252 0 O-C-N 123.603 0.565 . . . . 0.0 114.039 -173.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.76 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 0.6 OUTLIER -56.98 -43.87 82.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.951 0.405 . . . . 0.0 110.888 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.788 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 12.5 mt-10 -82.64 -32.84 28.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.97 -176.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -61.04 -37.1 81.4 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 18.7 tpt180 -82.07 -32.61 30.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.071 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.834 ' HA ' ' CZ ' ' A' ' 58' ' ' TYR . 34.9 tp -50.08 -46.94 53.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.236 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.446 ' SG ' HG23 ' A' ' 62' ' ' THR . 1.6 p -63.72 -17.78 63.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.722 -174.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.8 m-85 -62.75 -51.0 68.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.834 ' CZ ' ' HA ' ' A' ' 55' ' ' LEU . 1.8 p90 -87.32 -17.52 32.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.23 -175.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.2 mt -78.08 -31.1 49.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.443 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.27 91.31 2.21 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.872 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -160.06 -53.48 0.05 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.115 0.484 . . . . 0.0 110.044 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.446 HG23 ' SG ' ' A' ' 56' ' ' CYS . 2.9 p -82.3 139.35 34.22 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.58 178.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -81.81 6.35 15.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -90.17 5.8 45.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.539 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.54 -152.06 0.4 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.888 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.26 110.88 2.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.153 0.501 . . . . 0.0 110.908 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.9 p -84.99 -19.01 32.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.456 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -71.96 -47.33 53.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.232 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.524 HD11 HD22 ' A' ' 90' ' ' LEU . 14.5 tt -65.83 -16.94 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.11 -176.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.3 tt -54.17 -46.32 72.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.329 0.585 . . . . 0.0 109.624 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.415 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 7.1 m -67.89 -25.13 65.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.791 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -73.51 -18.17 61.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 44.5 t -88.54 -47.67 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.166 0.507 . . . . 0.0 110.848 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.616 ' HA ' HG21 ' A' ' 37' ' ' ILE . 55.9 p -59.06 -39.6 82.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.453 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.3 OUTLIER -61.31 -55.52 42.77 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.827 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.636 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 11.8 Cg_endo -61.05 -42.09 39.05 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 121.223 1.282 . . . . 0.0 112.742 177.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mmt -64.28 -20.69 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.676 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 33.6 t -60.36 -27.26 67.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.485 178.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 80' ' ' HIS . 4.7 p -127.5 -87.32 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.001 178.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.893 ' H ' HG13 ' A' ' 79' ' ' VAL . 39.3 m80 -150.69 -80.06 0.12 Allowed 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 177.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 35.1 mtp 68.81 167.4 0.12 Allowed Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 168.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.574 ' HB2' HG13 ' A' ' 86' ' ' ILE . 18.4 Cg_exo -40.65 -0.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.218 1 C-N-CA 127.553 5.502 . . . . 0.0 118.977 177.87 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.595 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -34.73 -46.23 0.28 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -156.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.695 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -52.13 -53.71 39.38 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.327 1.06 . . . . 0.0 109.644 174.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 34.2 tttp -76.29 -18.02 59.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.046 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.993 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 20.1 mt -60.67 -40.57 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 O-C-N 122.136 -0.352 . . . . 0.0 110.255 175.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 14.8 t -67.04 -19.98 65.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.172 0.51 . . . . 0.0 110.698 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 41.5 mt-10 -78.65 -40.23 34.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.448 0.642 . . . . 0.0 109.836 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.993 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.2 mtmp? -67.83 -30.78 70.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.115 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 69' ' ' ILE . 18.6 mt -66.81 -17.2 64.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.571 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.615 ' HG2' ' HB2' ' A' ' 98' ' ' CYS . 45.1 mtpt -68.71 -14.31 62.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.319 -177.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 89' ' ' LYS . 34.0 mtmm -62.04 -39.27 91.77 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.014 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 94' ' ' ASP . 5.9 mp -91.01 71.73 6.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.58 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 27.9 m-20 72.06 105.21 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.012 -175.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.2 m -70.42 -13.54 62.17 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.029 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -49.83 -34.41 19.71 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.926 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.581 HG23 ' HD2' ' A' ' 58' ' ' TYR . 73.3 mt -52.66 -31.14 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.536 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.65 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 5.0 t -86.54 -18.69 30.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.631 -173.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -111.12 52.38 0.74 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.439 0.638 . . . . 0.0 111.322 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.567 HD22 ' OH ' ' A' ' 58' ' ' TYR . 1.5 mp -103.02 -45.05 5.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.889 169.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.684 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 29.6 mmtp 64.33 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.248 -178.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.76 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.4 m-85 . . . . . 0 C--N 1.326 -0.445 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo . . . . . 0 N--CA 1.445 -1.359 0 N-CA-C 111.117 -0.378 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.901 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -72.33 -37.95 58.79 Favored Glycine 0 N--CA 1.439 -1.112 0 C-N-CA 119.601 -1.285 . . . . 0.0 111.936 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.991 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -173.7 -83.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.413 -176.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -162.67 -67.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.816 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' H ' ' A' ' 12' ' ' GLU . 5.4 m -57.52 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.679 0.612 . . . . 0.0 112.084 -175.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 4.4 tp10 -170.35 -75.98 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.495 0 O-C-N 122.063 -0.398 . . . . 0.0 111.055 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' ' 100' ' ' LEU . 38.9 t -55.6 -43.06 71.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.712 0.767 . . . . 0.0 109.968 179.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' HD21 ' A' ' 55' ' ' LEU . 37.1 t -61.2 -36.16 79.12 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.172 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.64 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 3.2 ptpp? -77.91 -32.84 51.96 Favored 'General case' 0 N--CA 1.458 -0.052 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.11 -177.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 56.9 mm-40 -57.84 -52.5 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.523 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.78 -55.16 32.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.336 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 9' ' ' ALA . 82.9 mt -61.37 -46.08 91.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 121.335 -0.146 . . . . 0.0 111.207 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.901 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.4 t-20 -62.06 -52.95 61.86 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.987 0.179 . . . . 0.0 111.327 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.562 ' NH2' HG22 ' A' ' 48' ' ' THR . 51.1 mtm-85 -65.4 -41.86 93.21 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.562 -177.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -59.05 -49.13 79.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.831 0.824 . . . . 0.0 109.584 178.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.537 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 70.0 t80 -53.73 -55.35 27.04 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.256 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -67.39 -34.02 76.41 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.7 m -62.3 -33.9 75.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.933 0.397 . . . . 0.0 111.271 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.6 mp -77.46 -39.83 45.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.35 -45.84 92.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.246 0.546 . . . . 0.0 109.772 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.71 -51.53 68.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.569 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.735 ' HB2' HG12 ' A' ' 30' ' ' VAL . 90.2 mtm-85 -78.25 -13.47 59.84 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.8 25.87 68.51 Favored Glycine 0 CA--C 1.509 -0.322 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 -176.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.744 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 4.0 p -109.28 57.91 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 122.425 1.107 . . . . 0.0 109.683 -173.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.533 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.7 t-20 -140.7 -179.09 5.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.06 -172.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.437 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 44.8 t80 73.09 -55.84 0.67 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.254 1.021 . . . . 0.0 111.329 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.484 ' O ' HG13 ' A' ' 37' ' ' ILE . 22.3 m -60.52 109.75 1.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.834 0.349 . . . . 0.0 110.644 178.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.3 mm? -59.66 -38.88 82.67 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.858 -175.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -61.15 -38.39 86.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.311 0.577 . . . . 0.0 110.626 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 m -76.43 -41.65 46.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.196 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 33' ' ' SER . 61.1 mt -60.44 -32.3 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.13 -50.56 69.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.509 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.1 tptt -62.95 -35.2 79.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.844 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -74.2 -36.74 64.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.67 -178.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.446 HD12 HG23 ' A' ' 74' ' ' THR . 17.1 mt -58.36 -38.78 77.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 172.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.773 HG12 ' HA ' ' A' ' 62' ' ' THR . 96.1 mt -65.43 -49.3 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.905 176.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -63.64 -55.36 24.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.031 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -61.68 -29.45 70.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.666 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.553 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.5 t -54.23 -50.77 66.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 175.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.1 mt -88.42 -14.57 37.68 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.812 0.339 . . . . 0.0 111.833 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -94.93 -1.74 51.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 111.385 -174.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.796 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -85.58 -161.71 0.64 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.856 177.025 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -93.87 169.54 10.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.627 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -46.73 -52.24 11.68 Favored Glycine 0 N--CA 1.453 -0.176 0 O-C-N 123.769 0.668 . . . . 0.0 114.26 -170.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -63.72 -39.93 95.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.244 0.522 . . . . 0.0 110.821 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.796 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 50.3 mt-10 -72.21 -31.19 65.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.515 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 12.9 m120 -66.79 -21.05 66.05 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.667 175.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 7.0 mmm180 -86.01 -44.6 12.18 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.585 HD11 HG23 ' A' ' 97' ' ' ILE . 27.8 tp -59.58 -24.87 64.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.427 -1.26 . . . . 0.0 112.598 -172.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 7.6 p -63.84 -34.85 78.85 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.536 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -74.84 -17.09 60.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.147 0.498 . . . . 0.0 110.003 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.579 ' HB3' HG12 ' A' ' 97' ' ' ILE . 63.0 m-85 -85.41 -51.59 6.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.759 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.29 -46.65 89.42 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.962 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.553 ' O ' ' HA ' ' A' ' 70' ' ' LEU . . . 131.9 59.78 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.968 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -128.85 169.53 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.773 ' HA ' HG12 ' A' ' 42' ' ' ILE . 16.9 p 66.21 142.66 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.295 1.038 . . . . 0.0 111.65 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.448 ' HB3' ' NZ ' ' A' ' 63' ' ' LYS . 9.3 mtpm? -90.73 19.05 5.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -93.12 -27.81 16.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.814 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.81 -167.28 1.39 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.273 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.73 119.93 5.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.055 0.455 . . . . 0.0 110.991 178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.26 -16.16 44.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.667 -176.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 27.5 ttpp -62.73 -51.94 65.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.35 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 72' ' ' GLU . 8.5 tp -65.88 -25.73 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.553 ' HA ' ' O ' ' A' ' 60' ' ' GLY . 2.8 tt -61.4 -45.08 95.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.502 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 45.3 m -66.68 -35.14 79.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.304 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.476 ' HB2' HD12 ' A' ' 69' ' ' ILE . 42.4 mt-10 -68.86 -23.42 64.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.756 -177.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.482 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 91.6 t -88.01 -48.53 15.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.774 0.321 . . . . 0.0 111.371 174.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.446 HG23 HD12 ' A' ' 41' ' ' LEU . 7.9 p -54.02 -47.27 71.7 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -176.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.1 mpt_? -58.09 -53.29 67.45 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.745 -177.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.551 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 52.7 Cg_exo -56.74 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.78 1.654 . . . . 0.0 113.1 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.5 mmt -62.69 -14.05 39.47 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.823 0.344 . . . . 0.0 111.749 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 31.5 t -74.27 -14.87 60.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.262 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.647 HG22 ' H ' ' A' ' 80' ' ' HIS . 4.4 p -136.18 -178.15 2.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.647 ' H ' HG22 ' A' ' 79' ' ' VAL . 60.0 t-80 -56.09 -64.29 0.91 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 117.869 0.304 . . . . 0.0 110.336 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER 67.04 146.39 0.11 Allowed Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 51.7 Cg_exo -41.87 0.99 0.0 OUTLIER 'Trans proline' 0 C--O 1.21 -0.878 1 C-N-CA 126.838 5.025 . . . . 0.0 117.723 167.039 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.567 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.1 -34.53 0.06 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -159.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.991 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 1.1 mpp? -55.88 -56.64 18.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.872 0.844 . . . . 0.0 109.559 171.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 82' ' ' PRO . 44.4 mttm -68.54 -19.87 64.52 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.616 -1.174 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 83' ' ' ALA . 24.7 mt -60.87 -29.63 45.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.046 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.546 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 46.0 t -72.04 -34.34 68.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.428 0.632 . . . . 0.0 110.026 176.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.596 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 51.0 mt-10 -69.09 -41.12 77.91 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.681 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -76.11 -28.21 57.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.669 177.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 90' ' ' LEU . 6.9 mt -67.63 -28.15 67.48 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.995 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.596 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 25.7 mtpp -60.75 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.958 176.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -79.15 -13.89 59.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.374 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.2 mp -100.21 -49.57 4.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.647 174.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -142.09 118.78 11.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.906 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.2 p -85.65 -15.11 43.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.798 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -71.13 -29.99 65.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.585 HG23 HD11 ' A' ' 55' ' ' LEU . 95.4 mt -50.87 -40.36 20.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.907 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.426 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 49.6 t -71.36 -52.26 19.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.357 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -97.2 36.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.717 -171.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.597 ' O ' HG21 ' A' ' 13' ' ' VAL . 10.1 tp -84.65 37.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -54.02 145.54 16.51 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.351 -173.449 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo . . . . . 0 N--CA 1.456 -0.73 0 CA-C-O 121.208 0.42 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.841 ' H ' ' HD3' ' A' ' 15' ' ' LYS . . . -73.08 -42.64 43.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.107 -176.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.664 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -166.92 -82.68 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.175 0.512 . . . . 0.0 110.963 -172.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -162.16 -62.53 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.319 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 14' ' ' CYS . 4.8 p -77.76 148.13 34.98 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.24 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -58.91 -72.08 0.11 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -172.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 55' ' ' LEU . 6.1 p -51.38 -48.65 33.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -170.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 33.9 t -62.97 -43.18 99.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.924 0.392 . . . . 0.0 110.877 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.841 ' HD3' ' H ' ' A' ' 8' ' ' GLY . 5.2 ptpp? -72.32 -42.13 65.75 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.578 -175.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.61 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 37.0 mm-40 -57.88 -42.73 85.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.535 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -60.0 -51.46 69.57 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.418 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 66.5 mt -60.34 -45.04 94.87 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -50.92 -56.39 12.58 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 123.52 0.512 . . . . 0.0 112.109 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.626 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -58.67 -55.24 37.65 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.719 -177.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 69.2 t80 -59.08 -48.22 82.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.203 0.525 . . . . 0.0 111.073 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 46.4 t80 -53.3 -48.41 68.41 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.188 -174.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.413 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -85.69 -39.26 17.42 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.504 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -61.96 -32.44 72.87 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.761 0.315 . . . . 0.0 111.356 -178.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 11.5 tp -61.63 -41.94 98.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.307 0.575 . . . . 0.0 109.992 177.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.3 mm -75.26 -38.06 40.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.455 -177.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.14 -45.91 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.596 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -70.08 -23.7 63.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.051 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.36 -5.58 67.84 Favored Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.985 -0.626 . . . . 0.0 111.657 174.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.752 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -86.48 122.41 38.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.048 -0.576 . . . . 0.0 110.201 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -172.03 -177.99 2.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 174.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.465 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 94.9 m-85 71.19 -58.36 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.628 0.771 . . . . 0.0 112.145 178.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 37' ' ' ILE . 12.5 m -64.2 109.07 1.74 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.847 0.356 . . . . 0.0 110.15 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 75' ' ' ARG . 2.6 mm? -59.86 -37.74 80.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.874 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.08 -36.57 82.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.54 0.686 . . . . 0.0 110.045 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.409 HG22 ' CG2' ' A' ' 30' ' ' VAL . 56.6 m -80.09 -38.78 31.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.49 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 33' ' ' SER . 72.1 mt -62.89 -34.75 67.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -72.96 -38.74 66.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.554 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -58.49 -47.73 83.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 175.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.635 ' HG3' HG21 ' A' ' 30' ' ' VAL . 6.7 mm-40 -68.47 -41.42 80.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.526 -176.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.563 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 13.6 mt -55.79 -44.9 78.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 175.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.486 HD13 ' HD3' ' A' ' 63' ' ' LYS . 69.1 mt -62.7 -52.41 60.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.138 178.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.1 m -58.94 -47.34 85.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.959 0.409 . . . . 0.0 111.21 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.626 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 30.2 t80 -65.84 -36.25 82.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.746 -176.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 6.5 m -69.33 -33.29 72.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.8 mt -85.29 -31.7 22.92 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.373 -0.531 . . . . 0.0 109.938 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.25 70.02 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.72 0.771 . . . . 0.0 110.305 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -159.1 -162.33 1.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.284 177.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.64 170.41 9.35 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.286 -0.566 . . . . 0.0 111.145 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.53 -48.37 60.8 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.174 -169.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 11.5 mptt -67.44 -25.74 66.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.448 0.624 . . . . 0.0 111.562 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.45 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 36.5 mt-10 -77.97 -49.38 14.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -58.16 -40.59 81.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.467 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 54' ' ' ARG . 27.2 tpt85 -69.97 -40.35 75.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.214 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 13' ' ' VAL . 43.8 tp -61.25 -34.09 74.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.092 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 64.4 m -68.41 -14.71 63.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -67.7 -29.32 68.55 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -85.54 -39.3 17.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.092 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 66.8 mt -67.33 -31.93 72.54 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.183 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.523 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 109.31 -18.13 30.79 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.873 176.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.533 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -80.58 67.46 6.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.457 0.646 . . . . 0.0 111.393 -177.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 64' ' ' ASP . 25.0 m -155.15 145.7 22.17 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HD3' HD13 ' A' ' 42' ' ' ILE . 31.9 mmmt -76.46 2.97 12.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.261 0.553 . . . . 0.0 110.858 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.533 ' H ' HG22 ' A' ' 62' ' ' THR . 19.9 m-20 -125.27 29.34 6.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.334 171.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.28 170.84 14.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.464 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.51 117.46 18.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.047 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . 39.7 p -73.37 -14.1 61.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.712 -178.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -58.67 -56.33 23.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.62 0.248 . . . . 0.0 110.728 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.523 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.5 tt -69.23 -25.73 30.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.042 0.449 . . . . 0.0 110.377 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 67' ' ' THR . 20.2 tp -60.24 -48.67 80.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.686 174.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 20.8 m -66.05 -29.28 69.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.41 -21.43 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.965 175.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 57.3 t -87.65 -45.0 16.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.809 0.338 . . . . 0.0 111.35 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 28.7 p -57.72 -41.5 81.88 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.579 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.5 mpt_? -59.01 -54.97 51.22 Favored Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.611 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.586 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 50.5 Cg_exo -56.6 -43.13 58.03 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.946 1.764 . . . . 0.0 113.24 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.3 mmt -62.91 -13.75 38.25 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.465 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 40.6 t -69.64 -12.31 61.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.574 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -153.73 -166.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.786 ' H ' HG22 ' A' ' 79' ' ' VAL . 36.4 t-80 -60.54 -71.8 0.13 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.886 0.312 . . . . 0.0 110.911 -176.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.762 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 48.8 mmm 64.24 158.0 0.12 Allowed Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 170.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.762 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 52.1 Cg_exo -41.26 1.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.033 1 C-N-CA 128.4 6.067 . . . . 0.0 118.92 172.257 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.639 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.39 -24.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -162.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.652 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -67.96 -58.88 3.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.44 1.018 . . . . 0.0 109.963 173.233 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 64.0 pttt -76.62 -12.14 59.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 -176.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.682 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 16.8 mt -54.52 -35.23 31.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 173.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.481 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 48.8 t -71.34 -29.11 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.166 0.508 . . . . 0.0 110.319 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.654 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 9.0 tp10 -70.8 -38.5 73.34 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.562 0.696 . . . . 0.0 109.144 174.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.09 -20.94 64.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.119 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 69' ' ' ILE . 79.9 mt -78.87 -34.18 45.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.958 173.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.658 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 48.7 mtpt -62.91 -27.3 69.28 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.449 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -60.02 -29.23 68.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.627 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -96.4 -50.88 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.086 0.47 . . . . 0.0 110.258 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.658 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 12.5 t70 -134.57 123.5 23.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.3 m -86.2 -15.28 41.41 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -86.07 -25.66 25.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.171 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 94' ' ' ASP . 14.7 tt -55.47 -31.52 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 121.198 0.523 . . . . 0.0 110.89 178.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 91' ' ' LYS . 6.6 t -75.7 -55.73 5.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.364 0.602 . . . . 0.0 109.509 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -91.07 49.48 1.64 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.225 -176.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.66 ' HB3' HG11 ' A' ' 13' ' ' VAL . 0.6 OUTLIER -76.23 -47.85 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 176.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.447 ' H ' ' CG1' ' A' ' 13' ' ' VAL . 71.2 mmtt 66.37 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.532 0.733 . . . . 0.0 111.687 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . 0.794 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 96.9 m-85 . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.576 176.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 4.8 Cg_endo . . . . . 0 N--CA 1.455 -0.781 0 CA-C-O 121.113 0.38 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -75.87 -26.96 63.54 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.33 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . 177.12 -130.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 123.337 0.655 . . . . 0.0 109.421 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -132.81 -47.2 0.87 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.84 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 48.2 m -77.69 21.25 0.3 Allowed 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.664 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 34.3 tt0 71.4 -67.56 0.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 174.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.745 HG12 HD22 ' A' ' 55' ' ' LEU . 43.8 t -63.28 -55.66 21.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -170.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.782 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.4 p -64.33 -31.1 72.17 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 12.7 ttmt -58.88 -53.9 53.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.5 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 50.2 mm-40 -49.68 -54.67 17.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.655 176.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.32 -54.4 47.39 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.092 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.799 HD11 ' HB2' ' A' ' 87' ' ' CYS . 96.3 mt -57.44 -53.93 52.61 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.704 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -70.61 -43.36 69.47 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.854 -173.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.577 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 46.7 mtp180 -61.33 -41.23 96.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.195 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.466 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 41.1 t80 -59.47 -49.25 78.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.968 0.889 . . . . 0.0 109.631 175.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.588 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 25.7 t80 -58.05 -55.57 33.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.762 -1.563 . . . . 0.0 111.801 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -67.14 -27.72 67.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.714 0.293 . . . . 0.0 110.997 -176.149 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 17.0 t -68.82 -46.13 69.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.632 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -56.85 -52.84 63.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.913 -179.57 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.55 -40.29 88.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.386 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -69.28 -40.24 77.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.033 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -62.55 -31.53 72.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.965 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.3 8.92 40.14 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 174.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.514 HG23 ' N ' ' A' ' 31' ' ' ASN . 5.1 m -89.59 -154.98 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.964 -0.618 . . . . 0.0 109.539 179.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 1.106 ' HA ' HD11 ' A' ' 37' ' ' ILE . 22.9 t-20 78.94 91.55 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.747 0.784 . . . . 0.0 112.984 168.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.516 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 17.8 t80 166.45 -30.39 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.682 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG12 ' A' ' 37' ' ' ILE . 13.4 m -87.98 117.24 26.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.692 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.666 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.1 mm? -63.69 -41.04 98.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.307 -172.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.63 -25.89 65.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 89.7 m -78.97 -43.98 23.36 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.86 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 1.106 HD11 ' HA ' ' A' ' 31' ' ' ASN . 47.2 mm -58.61 -31.05 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG3' HD11 ' A' ' 70' ' ' LEU . 28.3 tt0 -57.33 -47.77 80.71 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.563 174.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.58 ' HD2' HD12 ' A' ' 42' ' ' ILE . 14.0 mmmm -76.5 -35.2 58.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.921 -178.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' HD11 ' A' ' 25' ' ' LEU . 23.8 mm-40 -62.18 -40.72 96.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.305 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.411 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 19.4 mt -58.9 -33.16 70.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.819 HG12 ' H ' ' A' ' 62' ' ' THR . 76.9 mt -74.64 -46.89 40.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.671 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.9 t -61.89 -47.54 84.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.361 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 32.1 t80 -68.31 -27.88 66.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.364 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 20.3 t -61.08 -28.97 69.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.004 0.43 . . . . 0.0 110.603 174.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -85.98 -42.04 14.35 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -78.17 49.07 0.79 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.03 0.443 . . . . 0.0 111.512 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.816 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -144.34 -173.54 4.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.971 178.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.69 175.85 5.51 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 121.211 -0.196 . . . . 0.0 110.626 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.66 -53.55 12.9 Favored Glycine 0 CA--C 1.522 0.477 0 N-CA-C 114.966 0.747 . . . . 0.0 114.966 -170.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -67.02 -29.56 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 117.62 0.71 . . . . 0.0 110.687 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.816 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 71.6 mt-10 -80.63 -36.25 32.88 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.513 -176.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -61.08 -53.33 58.41 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 173.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -57.91 -34.64 70.05 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.842 178.061 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.782 HD21 ' HA ' ' A' ' 14' ' ' CYS . 42.7 tp -60.93 -32.69 72.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.43 -175.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 10.3 p -66.94 -21.09 65.99 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.612 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -71.02 -22.96 62.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.127 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.596 ' HB3' HG12 ' A' ' 97' ' ' ILE . 97.3 m-85 -80.47 -35.21 35.16 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.45 -5.53 58.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.844 -179.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 95.17 17.96 35.45 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.992 170.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.402 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -89.31 -179.29 5.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.227 0.513 . . . . 0.0 111.414 -177.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.819 ' H ' HG12 ' A' ' 42' ' ' ILE . 63.2 p 59.6 15.83 4.91 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.531 1.132 . . . . 0.0 113.288 177.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 61.23 -178.94 0.11 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 122.604 0.362 . . . . 0.0 110.903 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.7 t70 71.74 -47.82 0.67 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.435 0.694 . . . . 0.0 110.974 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.27 155.92 27.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.78 112.85 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.889 0.376 . . . . 0.0 111.186 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.0 p -64.9 -14.13 58.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.532 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -49.36 -50.92 37.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 58' ' ' TYR . 18.6 tt -80.67 -24.39 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.699 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.565 HD11 ' HG3' ' A' ' 38' ' ' GLU . 3.4 tm? -57.04 -48.47 78.45 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.607 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 7.8 p -69.56 -35.16 75.14 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.853 177.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.46 -32.62 71.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.784 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.403 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 96.9 t -85.85 -47.08 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.503 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.509 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 7.4 p -55.44 -46.76 76.7 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.666 ' HA ' HD11 ' A' ' 34' ' ' LEU . 3.5 mpt_? -56.38 -56.72 28.75 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.949 -177.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.52 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 72.4 Cg_endo -75.26 -13.77 20.79 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 121.465 1.444 . . . . 0.0 113.836 -177.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.2 mmt -74.9 -33.22 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.067 0.46 . . . . 0.0 109.794 172.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.1 m -68.88 -14.5 63.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.561 -173.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.717 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.5 p -139.53 149.53 22.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.588 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 2.0 t60 -58.04 105.32 0.26 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -177.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.717 ' HG3' HG13 ' A' ' 79' ' ' VAL . 45.7 mtp -141.07 174.24 4.09 Favored Pre-proline 0 CA--C 1.541 0.606 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -169.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.64 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.9 Cg_endo -40.83 2.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.114 1 C-N-CA 128.301 6.001 . . . . 0.0 118.97 177.305 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . 0.58 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.74 -44.0 0.32 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -159.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.633 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -59.66 -37.62 79.23 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.033 0.833 . . . . 0.0 110.931 177.331 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 38.0 ttpt -84.81 -17.78 37.03 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.978 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 44.9 mt -61.8 -41.66 91.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.407 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' CYS . . . . . 0.799 ' HB2' HD11 ' A' ' 18' ' ' LEU . 46.6 t -64.65 -27.43 68.92 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.66 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 33.7 tt0 -70.06 -31.34 68.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.381 0.61 . . . . 0.0 109.57 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 53.7 mtmt -78.84 -28.61 44.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.92 174.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 88.0 mt -68.4 -23.85 64.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.298 176.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 50.6 mtpt -62.1 -25.04 67.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -75.25 -34.25 61.37 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.31 -52.14 36.94 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.743 ' HB3' HG13 ' A' ' 97' ' ' ILE . 29.2 t0 -160.7 124.61 3.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.263 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.6 m -74.24 -17.96 60.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.083 -176.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.0 tp60 -76.13 -14.04 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.081 0.467 . . . . 0.0 110.446 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.743 HG13 ' HB3' ' A' ' 94' ' ' ASP . 65.6 mt -67.12 -22.76 29.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.502 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 11' ' ' CYS . 14.2 p -117.52 -38.42 3.31 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.492 -176.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -85.11 56.87 4.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.571 ' HB2' HG21 ' A' ' 13' ' ' VAL . 6.1 mp -85.21 -49.37 8.27 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 174.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.7 mmtt 68.55 130.61 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 O-C-N 124.035 0.834 . . . . 0.0 112.079 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.167 -177.983 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 . . . . . 0 N--CA 1.482 1.147 0 CA-C-O 120.509 0.195 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 65.3 -169.87 0.2 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.347 169.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.42 147.22 14.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.809 -1.087 . . . . 0.0 108.598 177.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -62.48 109.4 2.61 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.578 -175.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 108.88 -8.48 33.88 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.199 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.401 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 26.0 mmt85 53.41 66.01 5.09 Favored Pre-proline 0 N--CA 1.466 0.335 0 CA-C-O 120.913 0.387 . . . . 0.0 111.612 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.401 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 25.3 Cg_endo -93.8 55.46 0.36 Allowed 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 123.34 2.693 . . . . 0.0 110.807 178.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.992 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -70.09 -50.83 26.2 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.544 -172.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.868 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -174.1 -91.56 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -169.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -134.75 -80.7 0.44 Allowed 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HB3' ' H ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -71.14 -88.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -172.38 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 36.9 tt0 -163.64 -77.83 0.04 OUTLIER 'General case' 0 C--O 1.218 -0.553 0 O-C-N 122.315 -0.24 . . . . 0.0 110.563 178.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.813 HG12 HD22 ' A' ' 55' ' ' LEU . 46.6 t -56.95 -40.36 71.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.013 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.685 ' HA ' HD21 ' A' ' 55' ' ' LEU . 35.8 t -59.78 -40.68 89.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.085 174.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.715 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 15.2 ptpt -75.97 -42.54 48.09 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.624 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 4.7 mm-40 -65.74 -40.9 92.6 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.006 -176.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -62.15 -54.82 35.72 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.62 177.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 95.5 mt -57.84 -52.74 64.21 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 122.957 0.161 . . . . 0.0 110.772 -177.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.992 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -60.14 -51.3 70.19 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 123.125 0.266 . . . . 0.0 111.391 -176.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 20' ' ' ARG . 23.4 mtm180 -67.58 -39.37 84.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.218 -175.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -64.2 -41.76 96.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 122.086 0.946 . . . . 0.0 109.667 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.706 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 14.5 t80 -64.81 -55.7 18.04 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.722 -173.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -76.16 -19.33 58.56 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.998 -176.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.6 t -64.59 -55.19 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.013 174.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.611 ' HA ' HG13 ' A' ' 30' ' ' VAL . 3.4 mp -59.74 -40.32 87.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.508 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.52 HG12 ' O ' ' A' ' 22' ' ' TYR . 51.4 mm -64.27 -43.19 97.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.945 0.402 . . . . 0.0 110.514 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -74.82 -43.74 53.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.461 -177.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.802 ' HB2' HG12 ' A' ' 30' ' ' VAL . 16.2 mtm180 -67.79 -14.38 62.91 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.954 0.407 . . . . 0.0 111.007 179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 73.19 28.4 66.33 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.802 HG12 ' HB2' ' A' ' 28' ' ' ARG . 3.4 p -111.93 51.81 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 CA-C-O 122.761 1.267 . . . . 0.0 109.27 -175.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.458 ' OD1' ' HA ' ' A' ' 78' ' ' SER . 9.2 t-20 -145.09 -167.32 2.64 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.318 -177.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.44 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 95.8 m-85 68.67 4.59 4.45 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 123.575 0.75 . . . . 0.0 111.139 -174.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 15.5 m -128.47 107.35 9.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.255 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.66 -37.48 78.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.921 -0.581 . . . . 0.0 112.064 -173.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -68.72 -32.75 72.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.238 0.542 . . . . 0.0 110.492 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.478 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 55.3 m -73.11 -42.16 63.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' SER . 53.7 mt -59.27 -32.97 49.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.25 0.547 . . . . 0.0 109.543 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -68.43 -44.16 75.56 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.034 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' HA ' HD12 ' A' ' 42' ' ' ILE . 47.5 tptt -69.91 -39.06 76.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.682 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -72.82 -28.31 62.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.904 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.3 mt -57.39 -46.87 82.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 168.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 39' ' ' LYS . 82.5 mt -56.06 -52.11 54.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.159 176.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.5 m -57.14 -55.66 31.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.714 -178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.88 -39.4 83.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.084 -173.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 56.9 m -62.93 -39.35 94.32 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 96.3 mt -85.35 -29.4 24.51 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.494 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -92.23 58.71 3.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.709 0.766 . . . . 0.0 110.582 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.408 ' C ' HD21 ' A' ' 53' ' ' ASN . 0.2 OUTLIER -153.98 -164.94 1.98 Allowed 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.88 -1.055 . . . . 0.0 109.295 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -98.11 167.33 10.95 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.398 178.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.99 -40.14 19.7 Favored Glycine 0 C--N 1.333 0.382 0 O-C-N 123.839 0.712 . . . . 0.0 114.298 -170.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 5.0 mptp? -51.86 -48.48 63.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.919 0.39 . . . . 0.0 111.221 179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -82.99 -35.44 25.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.198 -176.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.433 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 2.9 m120 -62.59 -33.95 76.0 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.56 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 23.5 tpt180 -83.42 -38.96 21.22 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.851 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.813 HD22 HG12 ' A' ' 13' ' ' VAL . 19.7 tp -55.34 -39.53 70.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 111.316 -178.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.76 -23.05 65.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -176.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.56 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 45.6 m-85 -61.78 -27.15 68.54 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.614 176.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.475 ' HB3' HG12 ' A' ' 97' ' ' ILE . 62.0 m-85 -86.33 -19.96 29.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.85 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.7 mt -102.2 -22.5 14.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.365 -174.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 124.73 -128.56 6.76 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.205 -0.522 . . . . 0.0 111.822 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.766 ' H ' ' HG ' ' A' ' 70' ' ' LEU . . . 57.24 -167.72 0.12 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.047 0.451 . . . . 0.0 112.201 175.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 58.3 p 56.68 11.04 0.8 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.085 0.954 . . . . 0.0 112.922 177.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt 60.8 13.98 4.81 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.879 0.472 . . . . 0.0 111.467 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' HB3' ' H ' ' A' ' 65' ' ' ALA . 3.4 m-20 -151.28 -161.65 1.38 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.088 -175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . 70.94 -84.03 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 O-C-N 123.817 0.698 . . . . 0.0 111.38 177.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -138.02 104.48 5.25 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.92 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.5 p -83.84 -26.31 29.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -170.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -77.09 -47.28 20.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.688 0.28 . . . . 0.0 111.029 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.1 tt -64.7 -21.07 28.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -178.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.766 ' HG ' ' H ' ' A' ' 61' ' ' ALA . 2.7 tt -55.06 -44.84 75.15 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.075 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.609 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 81.8 p -65.4 -29.57 70.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -74.19 -14.04 60.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.039 -178.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 52.9 t -88.25 -55.88 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 121.186 0.517 . . . . 0.0 110.615 171.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.403 HG22 HG22 ' A' ' 37' ' ' ILE . 34.4 p -58.25 -42.51 86.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.579 -173.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.609 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.1 mpt_? -59.14 -55.1 49.81 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -176.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.474 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 50.4 Cg_endo -72.18 -14.41 28.68 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 121.52 1.48 . . . . 0.0 113.17 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.85 -14.09 59.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.806 0.336 . . . . 0.0 110.51 175.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.458 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 43.6 t -80.9 -13.67 58.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.774 -177.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.73 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.2 p -146.36 149.53 15.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -175.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.706 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 5.7 t60 -60.38 107.78 0.71 Allowed 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.73 ' HG3' HG13 ' A' ' 79' ' ' VAL . 34.6 mtp -140.68 170.36 9.7 Favored Pre-proline 0 CA--C 1.533 0.317 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -167.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.498 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 23.8 Cg_exo -41.25 2.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.865 1 C-N-CA 128.149 5.899 . . . . 0.0 119.125 174.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.6 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.5 -24.37 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 -166.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.868 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -65.2 -57.44 8.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.819 0.819 . . . . 0.0 109.477 170.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 37.7 ttpt -70.27 -14.45 62.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.732 179.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 83' ' ' ALA . 38.2 mt -66.12 -27.09 39.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 O-C-N 122.06 -0.4 . . . . 0.0 110.539 177.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.685 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 50.8 t -75.61 -22.87 56.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.611 0.72 . . . . 0.0 109.65 175.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.8 mt-10 -75.64 -38.41 58.91 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.168 173.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttt -62.65 -35.99 81.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.647 171.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.552 HD12 ' HA ' ' A' ' 87' ' ' CYS . 21.4 mt -61.81 -28.68 69.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.313 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.589 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.7 mmmm -65.85 -24.06 66.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.602 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -81.69 -14.63 56.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.924 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.548 HD12 HD23 ' A' ' 90' ' ' LEU . 96.3 mt -94.37 -39.83 10.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.163 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -162.38 137.47 7.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.974 175.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 41.7 t -85.07 -21.92 29.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.163 -177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -68.59 -19.71 64.47 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.829 0.347 . . . . 0.0 110.844 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' HB3' ' A' ' 58' ' ' TYR . 51.7 mt -61.0 -30.17 47.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.305 0.574 . . . . 0.0 110.283 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.589 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 44.3 t -85.96 79.72 9.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.167 176.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.441 ' OE1' ' HG2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER 179.37 -139.11 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.896 174.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.557 ' O ' HG21 ' A' ' 13' ' ' VAL . 6.7 mp 63.63 21.98 12.95 Favored 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.739 0.649 . . . . 0.0 111.131 177.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.441 ' HG2' ' OE1' ' A' ' 99' ' ' GLU . 33.4 mmtp -46.15 134.53 8.39 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 123.729 0.643 . . . . 0.0 112.078 -170.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.598 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.0 m-85 -54.19 -59.29 4.85 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 123.388 0.43 . . . . 0.0 110.934 -174.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -136.67 91.7 2.68 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.924 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.652 ' HD3' ' H ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -77.3 -29.32 53.67 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 160.565 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-N 113.989 -1.46 . . . . 0.0 111.33 175.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.601 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 16.6 mm-40 . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 1' ' ' GLN . 5.2 pt-20 62.19 157.38 0.05 Allowed 'General case' 0 N--CA 1.474 0.745 0 O-C-N 124.732 1.27 . . . . 0.0 113.238 174.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.644 ' HB2' ' HG2' ' A' ' 23' ' ' LYS . . . -109.27 143.16 39.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.159 173.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.03 111.0 2.74 Favored Glycine 0 N--CA 1.452 -0.25 0 O-C-N 123.662 0.601 . . . . 0.0 113.185 -174.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 117.32 -16.58 12.8 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.453 177.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.575 ' HD2' ' OE1' ' A' ' 16' ' ' GLU . 13.2 mmt180 54.72 55.32 11.2 Favored Pre-proline 0 N--CA 1.467 0.408 0 C-N-CA 122.529 0.331 . . . . 0.0 111.804 -178.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 22.1 Cg_endo -97.04 71.05 0.11 Allowed 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 123.397 2.731 . . . . 0.0 112.223 -177.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -85.78 -37.46 9.41 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 119.818 -1.182 . . . . 0.0 112.271 -177.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.504 ' HB3' ' HB3' ' A' ' 15' ' ' LYS . . . 175.33 -109.54 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.19 0.596 . . . . 0.0 109.879 -174.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -149.85 -35.22 0.17 Allowed 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 172.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 91.8 m -67.67 101.98 1.12 Allowed 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 120.982 0.42 . . . . 0.0 109.943 173.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.682 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 39.3 tt0 -46.3 -59.9 2.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.645 -1.161 . . . . 0.0 113.895 -165.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.967 HG12 HD22 ' A' ' 55' ' ' LEU . 23.1 t -64.11 -47.97 87.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 121.356 0.598 . . . . 0.0 110.839 -176.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.8 ' HB2' HG22 ' A' ' 97' ' ' ILE . 5.1 t -59.22 -47.07 86.69 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.649 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 12' ' ' GLU . 10.3 ptmm? -64.81 -38.29 90.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.308 -176.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.682 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 15.8 mm-40 -65.02 -42.9 93.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.605 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -62.61 -51.41 67.41 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.624 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 58.2 mt -62.39 -54.81 34.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.738 -176.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.644 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 28.5 t-20 -58.18 -45.61 87.22 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.271 0.357 . . . . 0.0 111.843 -174.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HG2' ' HA ' ' A' ' 2' ' ' GLU . 87.0 mtm180 -64.11 -50.18 69.32 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.838 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -55.64 -47.65 76.27 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.328 1.061 . . . . 0.0 110.185 178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.717 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 3.2 t80 -56.89 -52.14 66.32 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 112.807 -1.997 . . . . 0.0 112.412 -171.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.644 ' HG2' ' HB2' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -83.46 -23.83 32.06 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.966 -177.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.639 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 42.6 m -57.02 -44.14 82.56 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.645 176.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.72 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 4.2 mp -63.91 -28.23 69.69 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.534 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 50.4 mm -71.63 -46.51 62.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 176.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.17 -46.9 81.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.587 -1.188 . . . . 0.0 111.859 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.86 ' HG3' HG23 ' A' ' 30' ' ' VAL . 20.5 ptp180 -85.31 -13.76 48.64 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.93 49.95 5.41 Favored Glycine 0 C--O 1.228 -0.239 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.439 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.011 HG13 HG22 ' A' ' 36' ' ' THR . 59.0 t -118.71 3.46 7.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 122.688 1.232 . . . . 0.0 110.338 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 31' ' ' ASN . 1.0 OUTLIER -96.92 174.49 6.76 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.303 -170.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 68.38 9.51 7.3 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.875 0.734 . . . . 0.0 112.018 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.465 ' O ' HG13 ' A' ' 37' ' ' ILE . 41.6 m -136.99 110.15 7.78 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 174.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -60.47 -35.14 75.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.988 -0.551 . . . . 0.0 112.313 -172.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.2 -36.24 74.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.375 0.607 . . . . 0.0 110.361 178.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 1.011 HG22 HG13 ' A' ' 30' ' ' VAL . 19.1 m -74.16 -39.87 62.95 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.494 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.501 HG22 HG22 ' A' ' 74' ' ' THR . 78.7 mt -61.37 -34.36 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.36 173.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.91 -50.33 69.15 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.909 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 mmmt -62.28 -42.15 99.1 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.708 -176.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.535 ' HG3' HG11 ' A' ' 30' ' ' VAL . 26.9 mm-40 -80.68 -16.78 53.09 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.723 -0.391 . . . . 0.0 111.503 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.59 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 24.3 tp -68.87 -41.23 78.67 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 172.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.581 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 1.7 mp -66.42 -41.44 88.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.46 173.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.434 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 32.2 t -64.03 -56.1 17.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.121 179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.632 ' HA ' ' HB3' ' A' ' 47' ' ' ASP . 22.2 t80 -62.73 -28.78 70.19 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.223 0.535 . . . . 0.0 109.982 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.581 ' HB3' ' O ' ' A' ' 42' ' ' ILE . 53.8 t -49.2 -52.28 27.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.628 174.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 71.6 mt -89.55 -18.37 26.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.776 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.632 ' HB3' ' HA ' ' A' ' 44' ' ' PHE . 27.6 t70 -63.83 -29.16 70.38 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 111.173 -177.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.683 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -73.5 -169.63 0.7 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.945 177.132 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.3 pttp -100.37 173.44 6.59 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.365 178.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -45.56 -41.63 9.51 Favored Glycine 0 C--N 1.332 0.359 0 O-C-N 123.961 0.788 . . . . 0.0 114.453 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.8 tptp -59.45 -53.63 55.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.889 0.345 . . . . 0.0 111.177 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.683 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 2.1 mp0 -75.72 -27.66 58.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.467 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -61.42 -40.46 94.49 Favored 'General case' 0 CA--C 1.521 -0.145 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 174.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpt180 -69.93 -43.42 71.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.197 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.967 HD22 HG12 ' A' ' 13' ' ' VAL . 23.9 tp -55.77 -35.81 66.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.941 178.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.8 t -62.97 -28.14 69.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.084 -178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -63.88 -31.94 73.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.153 0.501 . . . . 0.0 109.945 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -83.55 -23.21 32.12 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.357 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 97.1 mt -87.95 -7.69 56.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.987 175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.462 ' HA2' ' HB1' ' A' ' 65' ' ' ALA . . . 72.53 43.69 43.61 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.239 -0.891 . . . . 0.0 113.735 171.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.59 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -127.98 23.07 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.499 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.3 OUTLIER -113.02 -117.76 0.31 Allowed 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.531 -0.468 . . . . 0.0 111.092 -179.977 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.499 ' H ' ' HB ' ' A' ' 62' ' ' THR . 55.7 mtpt -129.05 142.73 50.81 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.635 -0.505 . . . . 0.0 109.635 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 60.88 31.42 20.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.723 0.773 . . . . 0.0 109.842 -178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.462 ' HB1' ' HA2' ' A' ' 60' ' ' GLY . . . -104.23 -178.54 3.69 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.621 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.508 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -69.39 119.85 14.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.987 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.4 p -70.32 -28.02 64.84 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.665 -178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -72.0 -45.73 59.85 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.125 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.777 HD11 HD11 ' A' ' 90' ' ' LEU . 14.6 tt -66.03 -28.76 44.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.443 -175.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.463 HD12 HD23 ' A' ' 41' ' ' LEU . 46.5 tp -57.13 -45.53 83.44 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.373 0.606 . . . . 0.0 110.419 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.653 ' O ' ' HD2' ' A' ' 75' ' ' ARG . 17.0 m -71.87 -37.48 70.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.246 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -64.33 -22.9 67.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.967 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 69' ' ' ILE . 94.3 t -86.19 -47.74 16.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-O 121.028 0.442 . . . . 0.0 110.864 174.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.501 HG22 HG22 ' A' ' 37' ' ' ILE . 11.6 p -58.27 -33.64 69.62 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -173.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 71' ' ' SER . 5.5 mtt180 -67.29 -55.39 15.55 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.607 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 29.2 Cg_endo -67.34 -16.79 48.86 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 121.261 1.308 . . . . 0.0 113.01 177.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.6 mmt -78.2 -14.41 59.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.641 0.257 . . . . 0.0 111.002 175.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.7 t -79.89 -14.73 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.669 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.7 p -150.06 150.09 13.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 -176.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.717 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 7.5 t60 -60.9 110.72 1.41 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.182 0.515 . . . . 0.0 110.122 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.669 ' HG3' HG13 ' A' ' 79' ' ' VAL . 48.2 mtp -137.6 173.73 5.11 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 112.345 -167.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.549 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 2.6 Cg_endo -40.64 0.9 0.0 OUTLIER 'Trans proline' 0 C--O 1.206 -1.081 1 C-N-CA 127.853 5.702 . . . . 0.0 118.863 175.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.591 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.41 -32.31 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 115.809 1.781 . . . . 0.0 115.809 -161.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.574 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 1.5 mtm -54.24 -48.05 71.54 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.965 0.888 . . . . 0.0 109.971 171.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.456 ' N ' ' O ' ' A' ' 82' ' ' PRO . 3.1 mptp? -70.34 -29.95 66.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.677 176.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.591 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 50.2 mt -64.71 -29.73 48.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.052 0.453 . . . . 0.0 110.184 -174.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' LYS . 52.6 t -61.28 -39.75 91.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.307 0.575 . . . . 0.0 109.993 172.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.51 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 15.8 mm-40 -72.05 -22.28 61.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.742 176.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -72.18 -38.87 69.0 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 173.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.777 HD11 HD11 ' A' ' 69' ' ' ILE . 2.8 mm? -66.76 -27.24 67.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.629 175.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.585 ' HD3' ' HB2' ' A' ' 98' ' ' CYS . 9.0 mmmm -63.51 -23.26 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.866 176.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -77.5 -17.45 57.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.778 177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.1 mp -95.31 -40.87 9.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.608 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -164.32 135.31 4.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.796 0.332 . . . . 0.0 110.695 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 67.7 m -86.26 -15.48 40.61 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -67.63 -21.67 65.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.246 0.546 . . . . 0.0 110.341 -176.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.8 HG22 ' HB2' ' A' ' 14' ' ' CYS . 57.3 mt -61.87 -23.58 31.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.33 176.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.585 ' HB2' ' HD3' ' A' ' 91' ' ' LYS . 24.2 t -89.43 -48.29 7.43 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.991 -177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -102.95 21.81 15.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.913 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 18.7 tp -61.95 -42.91 99.65 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.461 ' HD3' ' HA ' ' A' ' 101' ' ' LYS . 60.7 mmtt 63.79 163.3 0.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 114.55 -1.205 . . . . 0.0 113.883 174.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -107.79 -154.95 0.54 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.306 -1.316 . . . . 0.0 109.789 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' ' 103' ' ' GLU . 4.3 mp0 -63.09 -82.02 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.21 177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.523 ' HG2' ' H ' ' A' ' 105' ' ' THR . 14.7 ttmm 54.47 -150.79 0.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.248 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.523 ' H ' ' HG2' ' A' ' 104' ' ' LYS . 7.4 t . . . . . 0 C--O 1.25 1.105 0 C-N-CA 124.117 0.967 . . . . 0.0 112.84 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 120.472 0.177 . . . . 0.0 110.588 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 66.0 -91.42 0.03 OUTLIER 'General case' 0 C--O 1.233 0.199 0 C-N-CA 123.496 0.718 . . . . 0.0 111.416 -179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.06 -176.76 4.98 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.086 0.469 . . . . 0.0 111.597 -176.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 100.98 35.69 4.17 Favored Glycine 0 N--CA 1.446 -0.683 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -174.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 85.27 20.43 57.07 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.034 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.487 ' O ' ' HD2' ' A' ' 15' ' ' LYS . 18.0 mmm180 51.55 71.1 1.61 Allowed Pre-proline 0 N--CA 1.467 0.386 0 C-N-CA 122.74 0.416 . . . . 0.0 110.822 -176.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -90.28 69.85 1.61 Allowed 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 123.379 2.719 . . . . 0.0 111.207 -175.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.93 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -84.39 -26.18 40.61 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.808 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.598 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . -172.31 -83.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.119 0.485 . . . . 0.0 111.039 178.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t70 176.02 -27.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.864 -1.161 . . . . 0.0 107.864 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 5.4 m -73.09 -147.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 114.778 -1.101 . . . . 0.0 109.095 169.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.477 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . 35.5 tt0 -130.34 -73.84 0.55 Allowed 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.117 178.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.932 HG12 HD22 ' A' ' 55' ' ' LEU . 93.8 t -60.48 -47.92 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.498 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.675 ' HA ' HD21 ' A' ' 55' ' ' LEU . 41.9 t -58.56 -37.69 76.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.185 0.517 . . . . 0.0 110.154 174.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.716 ' HG3' ' CA ' ' A' ' 8' ' ' GLY . 27.7 ttpt -64.65 -55.55 19.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.847 -179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 61.9 mm-40 -58.94 -44.89 91.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.898 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -58.02 -56.66 19.18 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.237 0.335 . . . . 0.0 111.717 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.579 HD12 ' HB2' ' A' ' 87' ' ' CYS . 97.9 mt -60.1 -48.32 82.2 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 120.722 0.296 . . . . 0.0 111.022 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.93 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.0 t-20 -67.06 -41.72 85.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.355 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttp180 -78.05 -34.26 50.55 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.925 -175.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -61.46 -47.04 87.52 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.825 0.821 . . . . 0.0 109.246 172.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.725 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.6 t80 -56.59 -49.88 73.6 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 113.604 -1.635 . . . . 0.0 111.22 -177.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -71.57 -31.7 67.26 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.319 -179.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.506 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 73.1 m -60.16 -38.33 82.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.383 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CG2' ' A' ' 30' ' ' VAL . 4.3 mp -73.73 -22.46 59.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.011 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 46.9 mm -80.35 -43.81 21.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.03 -55.18 35.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.806 174.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 53.9 mtm-85 -78.93 -14.72 59.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.892 -175.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.24 31.66 74.91 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.765 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.662 ' CG2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 m -99.01 3.38 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 122.044 0.926 . . . . 0.0 110.47 -176.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.607 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.6 t-20 -83.62 174.15 10.78 Favored 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.093 -169.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 6.2 t80 75.39 -11.03 1.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.006 0.923 . . . . 0.0 110.795 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 37' ' ' ILE . 24.2 m -100.47 105.41 16.86 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.616 HD21 ' HE ' ' A' ' 75' ' ' ARG . 12.3 tp -62.78 -38.04 89.04 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.812 -171.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -63.0 -42.04 99.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.401 0.619 . . . . 0.0 110.215 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 62.7 m -67.27 -38.86 85.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.275 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 33' ' ' SER . 73.9 mt -58.18 -34.17 48.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.724 0.297 . . . . 0.0 110.284 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.406 ' HG3' ' CD2' ' A' ' 70' ' ' LEU . 35.8 tt0 -69.1 -45.26 70.67 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.463 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -62.94 -40.0 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.195 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.569 ' HG3' HG21 ' A' ' 30' ' ' VAL . 10.0 mm-40 -68.65 -39.39 80.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.309 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.639 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 17.9 mt -55.62 -55.64 29.66 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 120.767 0.318 . . . . 0.0 110.144 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.582 HD11 HD11 ' A' ' 70' ' ' LEU . 1.7 mp -57.47 -46.13 85.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.997 179.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.0 m -61.34 -51.09 70.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.491 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -61.88 -42.95 99.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.068 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 95.8 m -65.4 -28.59 69.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.521 -178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -86.62 -49.26 7.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -82.32 63.8 6.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.424 0.631 . . . . 0.0 111.067 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.401 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.5 OUTLIER -150.92 -161.45 1.34 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.693 178.644 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HG2' ' OE1' ' A' ' 52' ' ' GLU . 13.2 pttm -103.18 166.86 10.19 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 121.081 -0.248 . . . . 0.0 111.241 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.36 -43.48 26.96 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 124.068 0.855 . . . . 0.0 114.398 -170.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.811 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.0 mptt -58.37 -47.69 83.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.234 0.517 . . . . 0.0 111.249 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.408 ' OE1' ' HG2' ' A' ' 49' ' ' LYS . 40.7 mt-10 -71.82 -41.08 68.65 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.507 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -58.09 -44.18 87.49 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 9.1 tpp180 -70.01 -41.86 73.78 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.871 -178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.932 HD22 HG12 ' A' ' 13' ' ' VAL . 23.5 tp -53.62 -42.78 68.09 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.691 -177.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 86.2 m -67.34 -14.13 62.64 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.8 m-85 -72.31 -25.73 61.68 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 173.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.543 ' HB3' HG12 ' A' ' 97' ' ' ILE . 77.0 m-85 -84.99 -40.25 17.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.75 175.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 82.5 mt -74.08 -18.8 60.77 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.39 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.05 -13.5 63.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.293 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -85.59 75.44 10.13 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.21 0.529 . . . . 0.0 111.582 -176.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.582 HG22 ' H ' ' A' ' 63' ' ' LYS . 5.8 m -152.78 176.77 11.43 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 175.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.582 ' H ' HG22 ' A' ' 62' ' ' THR . 29.4 mtpp -63.17 -37.69 88.21 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -92.63 -152.69 0.32 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.201 -0.908 . . . . 0.0 109.21 174.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.52 -164.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 112.201 173.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -85.75 126.8 34.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.567 -175.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 62.4 p -86.18 -21.16 27.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.993 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -81.28 -44.92 17.01 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.361 -175.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.485 ' O ' ' HB2' ' A' ' 72' ' ' GLU . 13.9 tt -63.33 -24.61 36.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.428 177.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.582 HD11 HD11 ' A' ' 42' ' ' ILE . 3.3 tt -60.14 -44.25 95.09 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 174.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.646 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 19.0 m -66.51 -18.87 65.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.01 178.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.577 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 27.8 mm-40 -71.62 -56.08 6.53 Favored 'General case' 0 N--CA 1.446 -0.637 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 175.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.28 -45.25 84.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.41 0.444 . . . . 0.0 111.921 -175.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.4 p -55.24 -34.28 63.87 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -175.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.646 ' HD3' ' O ' ' A' ' 71' ' ' SER . 3.1 mpt_? -66.5 -56.45 15.32 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.86 -173.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.681 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 25.8 Cg_endo -65.61 -30.13 51.58 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.624 1.549 . . . . 0.0 112.977 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.2 mmt -67.79 -14.13 62.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.16 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -78.35 -15.27 58.88 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.451 -178.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.569 HG23 ' HG3' ' A' ' 81' ' ' MET . 4.0 m -144.23 -169.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.933 0.397 . . . . 0.0 111.386 -174.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.725 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 58.1 t60 -89.57 99.44 12.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.681 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 38.9 mtp -136.34 169.67 12.89 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -170.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.562 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.1 Cg_endo -42.44 -0.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.935 1 C-N-CA 127.809 5.672 . . . . 0.0 118.128 177.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.646 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.82 -35.07 0.08 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -159.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.65 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -65.72 -51.65 57.58 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 118.664 0.665 . . . . 0.0 110.513 177.014 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.637 ' H ' ' HG2' ' A' ' 84' ' ' MET . 42.7 mtmt -67.21 -19.49 65.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.711 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.646 HD12 ' HA ' ' A' ' 83' ' ' ALA . 27.9 mt -63.86 -28.97 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.912 -177.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.598 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 49.3 t -68.84 -35.07 76.51 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.717 176.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.872 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 67.7 mm-40 -68.21 -28.54 67.34 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.792 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.498 ' CD ' ' HA ' ' A' ' 86' ' ' ILE . 31.7 mttm -74.72 -40.14 61.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.24 177.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 92.3 mt -68.35 -25.21 64.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.183 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.872 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 58.2 mtpt -61.24 -21.24 63.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.526 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -76.18 -22.16 55.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.099 0.476 . . . . 0.0 110.386 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.2 -53.23 4.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 175.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.43 ' OD1' HG13 ' A' ' 97' ' ' ILE . 10.8 t70 -138.18 115.01 10.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.423 177.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 40.1 m -82.62 -15.01 53.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.792 0.33 . . . . 0.0 111.336 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.426 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 2.1 mp0 -65.74 -34.86 79.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.919 -177.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.543 HG12 ' HB3' ' A' ' 58' ' ' TYR . 78.3 mt -48.04 -42.0 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.47 176.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.623 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 35.9 t -72.68 -42.27 64.45 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.885 -173.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -81.31 14.5 2.39 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.67 116.03 21.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 170.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.477 ' HD3' ' HB3' ' A' ' 12' ' ' GLU . 32.4 mmtp -116.58 149.65 39.31 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.811 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 98.9 m-85 -71.89 -171.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.703 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 10.9 mm-40 -56.92 -54.57 45.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 171.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.703 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 0.0 OUTLIER 159.68 -14.06 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 O-C-N 124.785 1.303 . . . . 0.0 110.07 168.418 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 t . . . . . 0 C--O 1.253 1.258 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.103 177.831 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.976 ' HB2' ' HB3' ' A' ' 23' ' ' LYS . 5.8 mm100 . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.423 ' OE2' ' HD2' ' A' ' 6' ' ' ARG . 8.0 tp10 51.25 86.05 0.04 OUTLIER 'General case' 0 C--N 1.342 0.266 0 CA-C-O 121.276 0.56 . . . . 0.0 110.11 -169.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.599 ' HB3' ' HG3' ' A' ' 7' ' ' PRO . . . -76.11 9.18 2.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.354 -174.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 102.86 -46.06 1.27 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.936 177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -90.91 17.61 54.46 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.725 -178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.423 ' HD2' ' OE2' ' A' ' 2' ' ' GLU . 12.4 mmm180 55.49 75.36 0.6 Allowed Pre-proline 0 N--CA 1.466 0.349 0 C-N-CA 123.023 0.529 . . . . 0.0 110.899 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.599 ' HG3' ' HB3' ' A' ' 3' ' ' ALA . 70.4 Cg_endo -96.93 61.0 0.11 Allowed 'Trans proline' 0 N--CA 1.446 -1.293 0 C-N-CA 123.029 2.486 . . . . 0.0 111.605 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.674 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -96.71 -19.73 26.3 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.439 -176.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.779 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . 173.21 -153.08 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 123.208 0.603 . . . . 0.0 109.725 -175.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -121.39 -36.67 3.04 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.641 0.258 . . . . 0.0 110.354 -177.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 12' ' ' GLU . 42.3 m -56.36 -81.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.869 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.831 ' HA ' ' HE3' ' A' ' 15' ' ' LYS . 7.3 tp10 170.41 -79.73 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.727 0.299 . . . . 0.0 111.627 172.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.667 HG12 HD22 ' A' ' 55' ' ' LEU . 53.5 t -64.59 -38.16 81.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.477 -172.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 18' ' ' LEU . 21.7 p -60.24 -30.71 69.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.085 0.469 . . . . 0.0 109.797 174.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.831 ' HE3' ' HA ' ' A' ' 12' ' ' GLU . 0.1 OUTLIER -72.18 -41.65 66.75 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.219 -175.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' HH11 ' A' ' 20' ' ' ARG . 43.6 mm-40 -56.23 -48.47 76.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.667 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -61.55 -54.98 35.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.144 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 96.0 mt -59.57 -48.16 82.76 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -173.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.502 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.7 t-20 -68.5 -44.75 74.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.788 0.328 . . . . 0.0 111.139 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.466 HH11 ' HB3' ' A' ' 16' ' ' GLU . 30.7 mtp180 -64.63 -39.19 93.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.687 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 76.2 t80 -62.69 -50.24 71.92 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.954 0.883 . . . . 0.0 109.684 174.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.781 ' HD1' ' HG3' ' A' ' 1' ' ' GLN . 29.9 t80 -47.37 -55.06 9.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.469 -1.696 . . . . 0.0 110.84 177.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.976 ' HB3' ' HB2' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -68.74 -37.74 79.64 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.204 -179.303 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.627 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 27.2 t -59.23 -33.18 70.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.388 0.613 . . . . 0.0 110.758 -175.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.587 ' HA ' HG13 ' A' ' 30' ' ' VAL . 2.9 mp -83.04 -46.69 12.54 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.573 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 28.8 mm -67.34 -37.78 79.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.176 0.513 . . . . 0.0 110.225 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -72.28 -46.07 57.37 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.407 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.964 ' HG2' HG12 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -82.08 -14.15 56.24 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.031 0.443 . . . . 0.0 110.75 -177.028 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.58 1.78 60.28 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.061 172.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.964 HG12 ' HG2' ' A' ' 28' ' ' ARG . 1.9 p -87.94 99.02 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.12 0.486 . . . . 0.0 111.263 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.568 ' HA ' HD11 ' A' ' 37' ' ' ILE . 7.5 t-20 -165.73 -176.96 4.1 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.969 -0.457 . . . . 0.0 111.253 175.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 62.5 38.57 12.51 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.35 0.66 . . . . 0.0 111.54 -177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.599 ' O ' HG12 ' A' ' 37' ' ' ILE . 55.5 m -157.8 104.94 1.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.913 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.4 mm? -58.95 -43.68 91.29 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -172.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -60.46 -38.25 83.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.25 0.548 . . . . 0.0 110.715 176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.409 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 48.1 m -73.6 -40.82 63.55 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.333 -178.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.599 HG12 ' O ' ' A' ' 33' ' ' SER . 35.9 mm -58.58 -37.61 65.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -69.46 -44.26 71.58 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.389 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 32.3 mmtm -77.0 -18.8 57.96 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.925 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.592 ' HG3' HG21 ' A' ' 30' ' ' VAL . 62.1 mm-40 -85.35 -28.02 25.48 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.933 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HD21 ' A' ' 70' ' ' LEU . 13.2 mt -59.71 -55.46 34.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 168.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.44 HD12 ' HD3' ' A' ' 39' ' ' LYS . 60.4 mt -53.63 -43.85 55.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.069 176.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -63.85 -48.1 78.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.905 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.1 t80 -68.55 -32.92 73.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.854 0.359 . . . . 0.0 110.595 -176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 91.3 m -66.07 -22.62 66.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.946 0.403 . . . . 0.0 110.872 176.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.8 tp -87.64 -41.57 13.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.104 172.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -79.17 48.35 0.86 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.731 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -142.05 -172.65 3.62 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.521 177.773 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -97.56 173.46 7.14 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.58 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.51 -43.25 58.59 Favored Glycine 0 C--N 1.33 0.224 0 O-C-N 123.548 0.53 . . . . 0.0 114.022 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.7 tppt? -61.14 -42.25 98.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.135 0.493 . . . . 0.0 110.153 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 20.6 mt-10 -78.27 -37.56 44.74 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.766 -176.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -57.54 -40.57 79.12 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 176.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -78.96 -36.38 41.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.633 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.667 HD22 HG12 ' A' ' 13' ' ' VAL . 38.3 tp -53.63 -34.62 59.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.569 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 9.2 t -68.12 -15.35 63.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -74.56 -21.09 59.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.292 0.568 . . . . 0.0 109.964 176.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.551 ' HB3' HG12 ' A' ' 97' ' ' ILE . 98.7 m-85 -86.12 -34.56 20.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.008 174.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.7 mt -72.78 -36.11 67.55 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.503 176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.56 -3.76 34.6 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 121.057 -0.592 . . . . 0.0 113.862 172.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB2' HD21 ' A' ' 70' ' ' LEU . . . -92.44 53.22 2.05 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -173.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.405 ' HB ' ' H ' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -126.07 -84.94 0.62 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.058 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 62' ' ' THR . 27.5 mtpp -146.09 -70.21 0.26 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.138 0.494 . . . . 0.0 110.067 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -126.59 101.62 6.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.958 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -161.18 -79.47 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.753 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -148.41 60.99 1.09 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.308 -178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -68.65 -19.22 64.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.536 -177.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -81.51 -27.28 34.56 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.026 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.517 ' HB ' HD23 ' A' ' 93' ' ' LEU . 6.7 pt -86.11 -18.93 8.58 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-O 121.368 0.604 . . . . 0.0 109.547 175.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 61' ' ' ALA . 2.7 tm? -65.72 -26.85 67.94 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.712 -173.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.668 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 2.6 m -60.32 -27.85 67.67 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.322 0.582 . . . . 0.0 110.698 178.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.65 ' HA ' ' NH1' ' A' ' 75' ' ' ARG . 8.8 tp10 -72.2 -14.69 61.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.406 -179.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.574 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 58.1 t -87.91 -53.22 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.008 0.432 . . . . 0.0 110.484 172.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 p -55.48 -53.08 60.78 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -172.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.668 ' HD3' ' O ' ' A' ' 71' ' ' SER . 1.5 mtp-105 -58.48 -51.73 79.72 Favored Pre-proline 0 CA--C 1.536 0.438 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.686 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.731 ' HB3' ' SD ' ' A' ' 81' ' ' MET . 47.9 Cg_exo -61.52 -39.43 55.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.565 1.51 . . . . 0.0 113.361 179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.492 ' HG3' ' HE2' ' A' ' 21' ' ' PHE . 23.8 mmt -61.81 -16.68 51.91 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.882 0.372 . . . . 0.0 111.281 -178.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.567 ' HA ' ' OD1' ' A' ' 31' ' ' ASN . 40.6 t -75.31 -11.76 60.13 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.572 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -136.95 168.67 21.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -71.02 96.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.822 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -118.12 158.78 45.41 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.646 -0.706 . . . . 0.0 112.854 -163.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.822 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 25.0 Cg_exo -40.55 3.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.481 0.745 1 C-N-CA 127.831 5.687 . . . . 0.0 118.034 167.618 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.91 -29.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 116.921 2.193 . . . . 0.0 116.921 -163.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.674 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -64.51 -48.56 74.7 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.955 1.252 . . . . 0.0 109.583 173.116 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 34.8 ttmt -66.29 -20.7 66.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.198 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 83' ' ' ALA . 44.8 mt -66.22 -30.85 51.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.059 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 90' ' ' LEU . 50.0 t -78.46 -20.34 51.15 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.887 176.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.592 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 4.8 tp10 -64.34 -50.75 66.55 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 173.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.62 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 46.8 mtmt -63.17 -33.25 75.06 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.515 177.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.563 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 13.3 mt -61.87 -21.86 65.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.386 -0.824 . . . . 0.0 112.677 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.647 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 26.7 mtmm -64.61 -24.03 67.46 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.964 -176.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 92' ' ' LYS . 24.6 tptp -79.78 -19.09 49.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.205 0.526 . . . . 0.0 110.254 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.543 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.8 mp -85.87 -48.16 9.0 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -160.44 122.61 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.992 174.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.8 m -84.37 -14.01 50.67 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.007 0.432 . . . . 0.0 110.959 -175.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -75.28 -14.29 60.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.615 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.551 HG12 ' HB3' ' A' ' 58' ' ' TYR . 83.3 mt -60.61 -33.05 53.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 122.001 0.905 . . . . 0.0 109.181 170.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.647 ' SG ' ' HG2' ' A' ' 91' ' ' LYS . 90.9 m -87.67 -51.4 5.9 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.696 -1.138 . . . . 0.0 111.597 -177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -85.09 43.94 1.04 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.195 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.556 ' O ' HG21 ' A' ' 13' ' ' VAL . 0.7 OUTLIER -111.53 48.76 0.93 Allowed 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -62.01 158.04 17.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.913 . . . . 0.0 111.395 -172.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.464 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 71.2 m-85 -70.73 87.05 0.68 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.952 -178.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 68.57 90.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.003 176.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -94.69 110.68 22.5 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.29 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.5 p . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.652 -179.731 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.465 ' O ' ' HG3' ' A' ' 23' ' ' LYS . 0.0 OUTLIER 71.59 149.97 0.09 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.33 0.586 . . . . 0.0 111.62 176.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.92 5.31 2.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.522 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 121.72 67.25 0.25 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.694 177.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.01 32.73 38.8 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.105 -0.569 . . . . 0.0 112.647 176.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? 52.58 65.85 5.6 Favored Pre-proline 0 N--CA 1.465 0.309 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -83.56 47.27 2.29 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.437 2.091 . . . . 0.0 111.01 176.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.958 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -66.77 -41.2 93.79 Favored Glycine 0 N--CA 1.439 -1.132 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.525 -169.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.615 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -179.51 -82.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.545 0.688 . . . . 0.0 110.953 -173.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -165.21 -70.95 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.635 -178.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 p -68.33 128.92 38.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.429 175.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.673 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 34.2 mp0 -48.26 -76.92 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.84 HG12 HD22 ' A' ' 55' ' ' LEU . 59.3 t -51.73 -42.47 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 43.3 t -63.87 -46.23 85.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.073 0.463 . . . . 0.0 110.27 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.1 ptmt -68.96 -36.52 78.0 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.435 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.1 mm-40 -61.84 -51.38 68.47 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.096 -178.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -65.01 -54.51 29.29 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.334 -176.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.568 HD12 ' SG ' ' A' ' 87' ' ' CYS . 71.3 mt -58.08 -52.95 63.41 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 111.516 0.191 . . . . 0.0 111.516 -174.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.958 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -68.54 -36.2 78.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.937 0.399 . . . . 0.0 111.309 -175.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.2 ttm180 -73.68 -39.12 64.63 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.33 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.535 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 87.3 t80 -61.84 -49.37 76.56 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.589 0.709 . . . . 0.0 109.241 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.455 ' O ' HG12 ' A' ' 26' ' ' ILE . 40.8 t80 -48.86 -47.89 42.41 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.05 178.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 2' ' ' GLU . 4.7 mmtp -77.57 -46.93 20.75 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.6 t -57.7 -29.03 64.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.092 0.473 . . . . 0.0 110.683 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 3.9 tp -72.03 -41.61 67.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.446 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 22' ' ' TYR . 40.7 mm -68.66 -36.67 75.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 121.488 0.661 . . . . 0.0 109.637 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -64.39 -45.67 86.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.387 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.433 HH11 ' HD2' ' A' ' 28' ' ' ARG . 18.1 mtp180 -70.19 -26.1 63.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.404 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 98.82 22.95 12.44 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.564 175.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.672 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -125.41 126.7 71.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-N 114.749 -0.725 . . . . 0.0 109.339 -178.464 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' O ' HD11 ' A' ' 37' ' ' ILE . 2.0 t-20 -173.91 -45.18 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 175.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -79.54 47.36 0.82 Allowed 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.335 0.588 . . . . 0.0 111.784 -173.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 37' ' ' ILE . 20.4 m -157.88 109.56 2.29 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.825 177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.569 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.9 mm? -57.88 -41.64 82.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.977 -176.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -59.09 -41.95 89.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.409 0.623 . . . . 0.0 110.232 176.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.8 m -70.72 -42.65 70.29 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.514 -177.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.537 HD11 ' O ' ' A' ' 31' ' ' ASN . 67.3 mt -57.69 -37.39 59.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 177.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -71.16 -47.24 58.86 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.086 -178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.676 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.6 OUTLIER -60.97 -43.38 98.85 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.651 179.265 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.482 ' HG3' HG21 ' A' ' 30' ' ' VAL . 4.8 mm-40 -78.55 -27.04 45.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -176.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.535 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 6.2 mt -59.28 -48.83 80.14 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.7 mt -57.51 -47.27 85.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.67 175.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.5 m -60.05 -47.28 86.51 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.299 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -71.09 -38.51 72.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.48 -175.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.452 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 54.5 m -66.62 -28.65 68.66 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.3 tp -86.02 -20.14 29.28 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.093 0.473 . . . . 0.0 110.641 176.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -87.47 -24.64 24.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.314 -175.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -70.13 -173.76 0.72 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.846 -179.445 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -96.34 174.36 6.91 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.284 -179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.01 -47.86 39.68 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 114.758 0.663 . . . . 0.0 114.758 -169.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' HE2' ' H ' ' A' ' 103' ' ' GLU . 13.5 mptt -61.2 -36.35 79.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 117.258 0.529 . . . . 0.0 111.371 -179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.0 mt-10 -80.67 -38.75 28.48 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.094 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -58.1 -47.32 83.61 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 175.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -64.35 -38.5 91.25 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.735 178.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.84 HD22 HG12 ' A' ' 13' ' ' VAL . 34.1 tp -57.88 -36.87 72.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.811 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 91.5 m -70.92 -17.39 62.69 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -69.72 -29.7 67.16 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -86.17 -38.61 17.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.36 177.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 72.1 mt -73.22 -25.88 60.91 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.571 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.618 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.12 -9.52 42.95 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.476 -0.868 . . . . 0.0 113.487 174.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -81.78 55.85 2.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.724 0.773 . . . . 0.0 111.118 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.405 ' C ' ' H ' ' A' ' 64' ' ' ASP . 24.8 m -156.82 140.71 16.19 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -75.68 19.72 0.19 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.039 0.447 . . . . 0.0 112.023 -174.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 62' ' ' THR . 1.2 m-20 -127.16 1.93 6.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.886 176.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.92 -174.16 2.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.775 -172.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.421 ' HB3' HG22 ' A' ' 69' ' ' ILE . . . -67.66 136.51 54.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.961 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.0 p -84.41 -35.52 23.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.854 -175.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.1 mmmm -72.88 -22.49 60.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.07 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.618 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.1 tt -85.67 -24.92 6.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.256 178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.614 HD13 ' HA ' ' A' ' 61' ' ' ALA . 21.2 tp -61.5 -43.55 98.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.439 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.604 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 16.0 p -68.57 -23.01 64.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 177.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -75.89 -19.94 58.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.652 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.44 ' O ' ' HG2' ' A' ' 77' ' ' MET . 48.3 t -88.73 -52.09 11.5 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.282 172.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.511 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 18.4 p -55.27 -49.45 72.05 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.604 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.0 mpt_? -55.46 -54.59 49.41 Favored Pre-proline 0 CA--C 1.537 0.458 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -176.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.459 ' HB3' ' HE2' ' A' ' 81' ' ' MET . 27.7 Cg_endo -66.49 -13.27 39.22 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 121.898 1.732 . . . . 0.0 114.41 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.44 ' HG2' ' O ' ' A' ' 73' ' ' VAL . 24.4 mmt -77.25 -25.38 51.47 Favored 'General case' 0 C--N 1.318 -0.784 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.087 176.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 t -73.63 -13.97 61.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.202 -175.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.37 163.53 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -175.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.42 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 75.2 t60 -70.14 89.28 0.63 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.36 0.527 . . . . 0.0 110.201 178.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.496 ' HG2' ' HD2' ' A' ' 82' ' ' PRO . 5.3 mtp -110.29 176.86 1.37 Allowed Pre-proline 0 C--N 1.318 -0.767 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.337 -176.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.545 ' O ' HG13 ' A' ' 86' ' ' ILE . 33.1 Cg_exo -42.69 -0.17 0.01 OUTLIER 'Trans proline' 0 C--O 1.212 -0.801 1 C-N-CA 126.113 4.542 . . . . 0.0 116.904 171.162 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.748 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.55 -41.07 0.64 Allowed 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.133 1.333 . . . . 0.0 114.052 -169.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.696 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -61.98 -56.87 14.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.043 0.925 . . . . 0.0 109.543 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 39.3 ttmt -62.07 -14.53 37.18 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.232 178.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 83' ' ' ALA . 42.0 mt -70.51 -26.01 27.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 O-C-N 122.037 -0.414 . . . . 0.0 111.3 -177.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.568 ' SG ' HD12 ' A' ' 18' ' ' LEU . 84.8 m -73.05 -17.48 61.42 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.816 0.817 . . . . 0.0 110.213 173.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.9 mt-10 -85.94 -45.34 11.59 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.187 171.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 86' ' ' ILE . 26.4 ttpp -64.06 -38.18 90.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.35 -1.295 . . . . 0.0 111.384 -178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.4 mt -68.19 -14.48 63.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -66.82 -14.92 63.21 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.953 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -67.36 -29.13 68.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.463 0.649 . . . . 0.0 109.56 173.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.409 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.6 mp -94.23 -47.41 6.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.109 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.411 ' OD2' HG13 ' A' ' 97' ' ' ILE . 23.4 t70 -161.27 124.15 3.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.022 -179.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.4 p -86.82 -16.16 37.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.739 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.666 ' HA ' ' HG2' ' A' ' 99' ' ' GLU . 1.9 mp0 -72.15 -19.67 61.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.717 0.294 . . . . 0.0 111.346 -175.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.411 HG13 ' OD2' ' A' ' 94' ' ' ASP . 71.3 mt -54.66 -30.8 22.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.332 0.587 . . . . 0.0 110.585 174.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 13.3 m -82.45 -24.76 34.12 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.592 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.666 ' HG2' ' HA ' ' A' ' 96' ' ' GLN . 11.8 pt-20 -100.6 20.65 14.69 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -54.45 -63.6 1.1 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.607 ' HB2' ' HA ' ' A' ' 104' ' ' LYS . 69.5 mmtt 66.19 131.7 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.748 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -67.12 101.03 0.83 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.278 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.407 ' H ' ' HE2' ' A' ' 51' ' ' LYS . 31.1 mm-40 65.03 33.59 9.52 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.699 -173.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.607 ' HA ' ' HB2' ' A' ' 101' ' ' LYS . 0.1 OUTLIER 60.12 45.23 12.03 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.365 175.518 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.099 -0.953 . . . . 0.0 109.922 173.143 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.443 ' HB2' ' H ' ' A' ' 2' ' ' GLU . 3.9 mm100 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.443 ' H ' ' HB2' ' A' ' 1' ' ' GLN . 6.4 mm-40 69.86 168.67 0.3 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 169.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.469 ' HB2' ' HG2' ' A' ' 23' ' ' LYS . . . -171.25 10.77 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 113.877 -1.51 . . . . 0.0 109.902 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.3 49.82 0.22 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.646 -0.788 . . . . 0.0 113.278 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 118.18 10.52 8.84 Favored Glycine 0 CA--C 1.516 0.142 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.923 176.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.64 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 5.5 tpt180 54.85 43.27 1.3 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 123.037 0.535 . . . . 0.0 112.327 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.64 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 64.6 Cg_endo -103.42 78.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.389 0 C-N-CA 122.961 2.44 . . . . 0.0 112.472 -173.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.771 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -88.09 -23.17 38.89 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.883 175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.534 ' N ' ' HG2' ' A' ' 15' ' ' LYS . . . 172.92 -129.64 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.33 -0.935 . . . . 0.0 108.487 -175.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -139.3 -33.38 0.62 Allowed 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.429 -1.322 . . . . 0.0 107.429 169.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.618 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 26.5 m -60.38 106.33 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.976 167.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -48.88 -69.52 0.12 Allowed 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -165.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.546 HG11 ' HB2' ' A' ' 100' ' ' LEU . 14.3 p -59.46 -31.37 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.613 0.721 . . . . 0.0 110.52 -174.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 11' ' ' CYS . 51.2 t -69.88 -35.81 74.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.371 178.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.618 ' HG3' ' O ' ' A' ' 11' ' ' CYS . 55.9 mtpt -57.04 -53.79 54.05 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.266 0.555 . . . . 0.0 109.915 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.534 ' HB3' HH11 ' A' ' 20' ' ' ARG . 13.5 mm-40 -53.7 -51.78 62.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.318 -177.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.663 ' HE2' ' HA ' ' A' ' 45' ' ' CYS . 43.6 t80 -61.4 -55.44 31.38 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.86 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.3 mt -60.95 -49.41 77.55 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 -174.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.771 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 25.5 t-20 -68.56 -46.8 68.52 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.354 -174.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.534 HH11 ' HB3' ' A' ' 16' ' ' GLU . 46.2 mtp180 -63.18 -41.27 99.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.114 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -59.03 -48.67 80.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.622 0.725 . . . . 0.0 109.827 175.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.664 ' HE2' ' H ' ' A' ' 81' ' ' MET . 47.9 t80 -51.91 -55.85 17.72 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 113.982 -1.463 . . . . 0.0 111.201 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -73.51 -30.23 62.99 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.329 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.602 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 71.9 m -64.62 -45.85 85.13 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 121.205 -0.198 . . . . 0.0 110.47 178.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.2 mp -63.46 -41.41 98.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.588 0.233 . . . . 0.0 111.36 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.533 HG12 ' O ' ' A' ' 22' ' ' TYR . 39.7 mm -67.23 -40.03 84.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.057 0.456 . . . . 0.0 110.278 177.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -68.57 -44.94 73.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.148 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 28' ' ' ARG . 10.2 mtp180 -72.04 -15.26 62.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.325 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.1 39.43 27.39 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 111.282 -0.727 . . . . 0.0 111.282 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.628 HG21 ' HG3' ' A' ' 40' ' ' GLU . 0.7 OUTLIER -130.92 98.76 3.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.204 0.526 . . . . 0.0 110.123 -177.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.4 HD22 ' CD1' ' A' ' 37' ' ' ILE . 1.4 t-20 -168.49 -177.83 3.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.057 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 57.3 31.98 21.01 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.289 0.566 . . . . 0.0 111.515 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.588 ' O ' HG12 ' A' ' 37' ' ' ILE . 62.8 m -150.75 107.56 3.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.028 -0.731 . . . . 0.0 109.028 176.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.706 HD13 ' HE ' ' A' ' 75' ' ' ARG . 95.1 mt -60.09 -41.64 92.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.207 -0.906 . . . . 0.0 112.391 -170.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -67.59 -28.94 68.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.257 0.551 . . . . 0.0 109.874 -178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 m -78.14 -37.5 45.94 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.859 -179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 33' ' ' SER . 17.0 mm -64.6 -32.54 58.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.476 ' CG ' HG21 ' A' ' 74' ' ' THR . 41.1 mt-10 -66.01 -23.68 66.61 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.694 178.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -85.77 -52.48 5.74 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.147 0.498 . . . . 0.0 110.382 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.628 ' HG3' HG21 ' A' ' 30' ' ' VAL . 7.1 mm-40 -71.64 -25.9 62.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.46 -171.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.63 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 7.3 mt -58.45 -38.38 77.4 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 171.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.1 mt -74.71 -45.96 43.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.144 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 m -57.58 -45.21 85.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.177 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -78.3 -32.93 49.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.954 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.663 ' HA ' ' HE2' ' A' ' 17' ' ' PHE . 0.1 OUTLIER -73.06 -19.41 61.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.342 0.591 . . . . 0.0 110.14 -179.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 48.0 tp -86.35 -41.23 14.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.044 170.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.73 63.61 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.661 0.743 . . . . 0.0 110.492 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.742 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.2 OUTLIER -158.71 -172.42 3.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.29 -0.868 . . . . 0.0 109.595 -179.146 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -98.71 171.49 8.07 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 121.322 -0.151 . . . . 0.0 111.061 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.69 -43.88 38.12 Favored Glycine 0 CA--C 1.521 0.416 0 O-C-N 123.644 0.59 . . . . 0.0 114.573 -171.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 7.7 tptp -63.09 -35.36 80.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.312 0.577 . . . . 0.0 110.681 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.742 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 16.0 mt-10 -85.48 -36.43 20.56 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.242 -176.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.578 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 14.1 m120 -61.39 -39.06 89.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.552 175.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 19.7 tpt180 -75.08 -35.72 61.79 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.1 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD13 HD12 ' A' ' 100' ' ' LEU . 49.6 tp -58.66 -25.18 62.51 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.333 0.587 . . . . 0.0 110.361 175.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 53' ' ' ASN . 13.2 t -62.29 -32.38 73.09 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.391 176.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -74.91 -17.92 60.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 0.0 109.807 177.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.68 ' HB3' HG12 ' A' ' 97' ' ' ILE . 84.8 m-85 -86.08 -55.13 4.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.904 176.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.0 mt -65.8 -18.36 65.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.642 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 82.64 36.13 17.37 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.416 175.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.404 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -93.63 16.87 12.78 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.215 0.531 . . . . 0.0 110.587 -179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.489 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -132.91 128.58 36.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.468 178.097 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HA ' HG23 ' A' ' 67' ' ' THR . 54.9 mtpt -76.91 -10.3 59.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.182 0.515 . . . . 0.0 110.262 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -74.86 -14.82 60.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.039 174.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.29 -139.65 0.32 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.872 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.63 102.04 0.06 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.158 0.504 . . . . 0.0 109.93 175.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.469 HG23 ' HA ' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -86.39 -37.84 17.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.149 -169.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -72.28 -35.96 68.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.511 -172.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.642 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.3 tt -64.12 -23.85 34.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.266 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.8 tt -54.97 -49.95 70.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.462 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 8.0 m -66.48 -27.19 67.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.753 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -75.29 -21.51 58.44 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.064 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.537 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.0 t -87.21 -41.91 14.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.943 173.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.476 HG21 ' CG ' ' A' ' 38' ' ' GLU . 39.7 p -60.68 -42.03 96.3 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.706 ' HE ' HD13 ' A' ' 34' ' ' LEU . 4.3 mpt_? -55.69 -53.47 62.36 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 120.97 -0.292 . . . . 0.0 111.517 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.537 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 31.8 Cg_exo -62.52 -45.78 13.56 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.865 1.71 . . . . 0.0 112.828 173.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 14.3 mmt -62.78 -14.81 49.5 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.417 ' HB2' HD23 ' A' ' 34' ' ' LEU . 40.4 t -66.79 -14.45 62.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.423 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.02 162.26 34.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -61.63 107.1 0.75 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 175.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.843 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -119.68 153.42 54.37 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -163.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.843 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 24.9 Cg_exo -40.56 3.48 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.952 1 C-N-CA 127.923 5.749 . . . . 0.0 117.919 167.183 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.729 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.59 -31.7 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 115.618 1.71 . . . . 0.0 115.618 -164.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.496 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.8 OUTLIER -50.93 -49.32 60.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.462 0.648 . . . . 0.0 110.257 173.158 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 18.0 ptpt -85.81 -15.16 42.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.474 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.808 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 15.2 mt -59.39 -42.67 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 110.505 -0.183 . . . . 0.0 110.505 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.565 ' HA ' HD12 ' A' ' 90' ' ' LEU . 19.4 t -67.32 -22.07 65.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.286 0.565 . . . . 0.0 111.102 179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.422 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 15.5 tp10 -76.41 -44.16 37.25 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 174.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.808 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 10.1 mtmp? -61.11 -24.96 66.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.17 176.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 87' ' ' CYS . 23.1 mt -66.75 -17.82 65.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.264 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -63.53 -20.62 65.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.782 0.325 . . . . 0.0 110.806 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -69.04 -29.51 67.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.181 0.515 . . . . 0.0 110.333 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.56 -59.49 2.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.321 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -151.33 134.2 15.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.345 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.9 m -85.24 -19.55 31.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.465 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -68.07 -30.87 70.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.894 0.378 . . . . 0.0 110.668 -176.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.68 HG12 ' HB3' ' A' ' 58' ' ' TYR . 20.2 mt -56.55 -33.55 39.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.234 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.609 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 53.7 t -75.04 -35.98 61.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.748 -174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -85.99 -107.92 0.05 Allowed 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.9 -0.32 . . . . 0.0 111.298 -174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 55' ' ' LEU . 73.7 mt 64.39 -69.45 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.888 0.475 . . . . 0.0 111.059 -174.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 70.2 149.25 0.08 Allowed 'General case' 0 C--O 1.231 0.119 0 O-C-N 123.931 0.769 . . . . 0.0 110.836 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -73.06 -47.4 44.99 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.357 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -130.28 -17.84 3.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.101 -178.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt 63.53 39.05 9.31 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.653 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.661 178.649 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 . . . . . 0 N--CA 1.478 0.938 0 CA-C-O 121.513 0.673 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.743 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 7.9 mp0 -141.42 -168.4 2.63 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -175.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.6 ' HA ' ' HB2' ' A' ' 6' ' ' ARG . . . -116.85 -87.33 0.61 Allowed 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 166.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.83 -99.72 0.1 OUTLIER Glycine 0 CA--C 1.517 0.184 0 C-N-CA 121.149 -0.548 . . . . 0.0 112.607 -179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.43 -27.62 73.68 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.435 -0.666 . . . . 0.0 111.435 174.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.6 ' HB2' ' HA ' ' A' ' 3' ' ' ALA . 30.7 mtm180 -73.18 141.74 81.37 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 10.1 Cg_endo -90.1 86.99 0.37 Allowed 'Trans proline' 0 N--CA 1.444 -1.436 0 C-N-CA 123.175 2.584 . . . . 0.0 111.226 -171.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.599 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -76.14 -29.94 57.91 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 119.065 -1.541 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.467 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.43 -94.08 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 114.481 -0.86 . . . . 0.0 109.201 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.444 ' HB3' ' CD ' ' A' ' 88' ' ' GLU . 19.3 t70 -164.25 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 170.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 92.5 m -59.8 166.72 2.47 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.402 166.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 40.2 tt0 -89.77 -77.73 0.38 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -167.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.852 HG12 HD22 ' A' ' 55' ' ' LEU . 59.6 t -55.04 -42.57 65.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.289 0.566 . . . . 0.0 111.322 -170.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.673 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.8 t -63.51 -36.0 82.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.73 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.528 ' HG3' ' N ' ' A' ' 16' ' ' GLU . 2.5 ptpp? -69.25 -35.61 76.29 Favored 'General case' 0 CA--C 1.52 -0.209 0 C-N-CA 120.28 -0.568 . . . . 0.0 109.68 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.528 ' N ' ' HG3' ' A' ' 15' ' ' LYS . 61.7 mm-40 -56.88 -55.15 38.18 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.628 177.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -57.42 -55.04 39.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.821 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.577 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.0 mt -61.5 -38.84 88.78 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.048 -173.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -64.45 -55.36 21.39 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.17 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.743 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 0.9 OUTLIER -53.57 -55.56 24.6 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 176.132 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -52.24 -50.71 61.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.529 0.68 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.586 ' O ' HG12 ' A' ' 26' ' ' ILE . 54.9 t80 -53.79 -55.27 27.95 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 113.998 -1.456 . . . . 0.0 111.257 -178.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.501 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.95 -34.02 59.84 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.527 -176.233 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 75.2 m -58.29 -46.26 86.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.324 0.583 . . . . 0.0 110.664 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.605 ' HG ' ' HB ' ' A' ' 30' ' ' VAL . 2.4 mp -66.33 -44.91 81.99 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.072 178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 22' ' ' TYR . 48.6 mm -59.88 -38.69 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.776 0.322 . . . . 0.0 110.608 177.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -64.1 -39.38 93.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.864 177.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HB3' HG23 ' A' ' 30' ' ' VAL . 32.6 mtm180 -83.23 -14.85 52.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.115 -178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.0 15.35 62.99 Favored Glycine 0 N--CA 1.453 -0.177 0 N-CA-C 110.872 -0.891 . . . . 0.0 110.872 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.605 ' HB ' ' HG ' ' A' ' 25' ' ' LEU . 43.7 t -93.74 106.0 17.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 114.245 -0.978 . . . . 0.0 110.043 -177.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.758 ' HA ' HD11 ' A' ' 37' ' ' ILE . 1.0 OUTLIER -164.43 -55.26 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 118.499 -1.28 . . . . 0.0 114.212 176.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -78.74 59.04 2.43 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.637 0.732 . . . . 0.0 110.575 -174.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.8 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 13.5 m -157.95 101.65 1.79 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.063 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.45 -46.74 76.74 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.807 -176.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -64.93 -30.68 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.279 0.561 . . . . 0.0 110.47 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.8 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 51.6 m -76.02 -46.33 29.92 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.498 -177.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.758 HD11 ' HA ' ' A' ' 31' ' ' ASN . 32.3 mm -58.52 -33.8 49.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -63.27 -50.71 69.06 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.884 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -65.21 -39.0 92.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.357 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.509 ' HG3' HG11 ' A' ' 30' ' ' VAL . 53.6 mm-40 -70.19 -40.64 74.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.299 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.566 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 16.8 mt -55.5 -55.54 30.7 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 174.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 59.2 mt -54.76 -47.43 74.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.429 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.4 m -63.93 -51.27 65.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.503 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -67.05 -35.37 79.72 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.052 0.453 . . . . 0.0 110.353 -176.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.97 -33.63 75.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.243 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.1 mm? -87.63 -20.73 25.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.904 0.383 . . . . 0.0 111.419 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -74.68 -31.57 61.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.062 0.458 . . . . 0.0 111.262 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.769 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -69.66 -170.42 0.3 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.876 -178.255 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -95.82 171.18 8.81 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.113 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -42.68 43.63 Favored Glycine 0 N--CA 1.453 -0.205 0 O-C-N 123.687 0.617 . . . . 0.0 114.408 -169.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 51' ' ' LYS . 14.8 tptt -61.81 -39.27 91.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.519 0.676 . . . . 0.0 110.317 179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.769 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.0 mt-10 -80.81 -35.99 32.28 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.36 -175.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.455 HD21 ' C ' ' A' ' 48' ' ' THR . 3.9 m120 -63.42 -43.41 97.58 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.573 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 12.6 tpt180 -63.12 -37.38 86.97 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.661 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.852 HD22 HG12 ' A' ' 13' ' ' VAL . 61.6 tp -56.18 -45.09 79.87 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.633 176.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 57.3 m -71.01 -14.52 62.37 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.067 179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.573 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 9.9 m-85 -65.45 -32.21 73.71 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 172.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.544 ' HB3' HG12 ' A' ' 97' ' ' ILE . 91.1 m-85 -85.74 -39.11 17.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.267 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 95.8 mt -66.84 -19.84 65.81 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.891 177.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.558 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 86.79 12.12 69.46 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.023 174.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HB1' ' HB3' ' A' ' 41' ' ' LEU . . . -98.55 19.12 15.15 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.064 0.459 . . . . 0.0 111.894 -174.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 12.1 p -102.06 160.51 14.45 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -75.74 -4.7 41.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -168.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -124.4 19.55 8.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.12 0.486 . . . . 0.0 110.318 176.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.74 -178.3 3.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.775 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.69 119.39 18.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.59 -179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.5 p -74.06 -17.3 60.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.771 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -58.46 -50.5 73.51 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.558 HG23 ' HA3' ' A' ' 60' ' ' GLY . 12.9 tt -75.44 -31.08 23.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.184 178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.0 tt -56.3 -55.16 36.82 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.469 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 8.1 p -67.03 -29.62 69.48 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.072 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -65.48 -22.74 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.03 0.443 . . . . 0.0 110.41 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.675 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 98.1 t -85.81 -48.81 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.484 175.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.521 HG22 HG22 ' A' ' 37' ' ' ILE . 41.3 p -61.01 -36.91 80.77 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -175.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.431 ' HD3' ' O ' ' A' ' 71' ' ' SER . 2.1 mpp_? -54.47 -56.07 30.73 Favored Pre-proline 0 CA--C 1.534 0.352 0 C-N-CA 120.979 -0.288 . . . . 0.0 111.546 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.675 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 11.8 Cg_exo -71.67 -36.72 6.1 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.579 1.52 . . . . 0.0 112.436 174.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.449 ' HB2' ' HA ' ' A' ' 74' ' ' THR . 3.8 mmt -59.46 -20.52 55.77 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -60.8 -13.64 16.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.3 m -126.45 174.74 9.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -64.89 88.21 0.06 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.807 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 14.1 tpt -103.28 149.58 37.1 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -162.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.807 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 23.4 Cg_exo -41.41 3.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 127.771 5.647 . . . . 0.0 117.978 168.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.523 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.44 -27.52 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 116.076 1.88 . . . . 0.0 116.076 -165.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.599 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -53.12 -49.0 67.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.808 0.813 . . . . 0.0 109.476 171.615 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE3' ' HB3' ' A' ' 82' ' ' PRO . 41.1 mtmt -74.01 -30.41 62.44 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.315 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.551 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 39.6 mt -60.53 -41.44 87.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.942 -174.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.577 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 43.9 t -63.07 -33.0 74.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.318 0.58 . . . . 0.0 110.93 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.444 ' CD ' ' HB3' ' A' ' 10' ' ' ASP . 69.6 mm-40 -74.81 -36.07 62.47 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.119 179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.18 -28.24 66.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.015 175.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.449 ' HA ' HD13 ' A' ' 93' ' ' LEU . 28.8 mt -71.04 -15.77 62.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.302 177.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -69.8 -16.12 63.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.905 0.383 . . . . 0.0 110.334 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -68.92 -24.95 64.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.6 176.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 90' ' ' LEU . 7.0 mp -80.91 -53.53 6.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.719 176.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.481 ' HB3' HG13 ' A' ' 97' ' ' ILE . 24.2 t70 -164.66 143.16 6.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.846 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.2 p -79.34 -22.75 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -173.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -73.12 -20.29 60.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.933 0.397 . . . . 0.0 110.225 -177.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.544 HG12 ' HB3' ' A' ' 58' ' ' TYR . 10.1 mt -62.97 -33.1 58.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.177 -178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 14' ' ' CYS . 12.4 p -104.63 -28.45 11.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.855 0.36 . . . . 0.0 110.935 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -76.12 -94.32 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.169 -171.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 25.3 mt 65.71 -63.56 0.21 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.807 0.692 . . . . 0.0 111.948 -177.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt 71.01 123.59 0.03 OUTLIER 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.658 0.783 . . . . 0.0 111.192 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -63.2 154.79 30.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.775 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.9 95.45 0.06 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.777 0.673 . . . . 0.0 111.577 -172.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.732 ' HD3' ' H ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -93.1 0.58 57.3 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.954 179.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.25 1.083 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.036 178.437 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.669 ' HG2' ' HE2' ' A' ' 22' ' ' TYR . 19.3 mt-30 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.476 ' HG3' ' HG2' ' A' ' 23' ' ' LYS . 42.2 mt-10 68.56 -50.22 0.57 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.889 0.876 . . . . 0.0 112.246 -173.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.81 148.07 46.61 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.607 -177.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 114.13 36.3 1.37 Allowed Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 -176.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 69.35 30.51 71.4 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.192 -0.527 . . . . 0.0 112.015 -176.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 18.2 mmm180 56.87 68.46 2.11 Favored Pre-proline 0 N--CA 1.462 0.173 0 CA-C-O 120.924 0.392 . . . . 0.0 110.318 -176.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.32 51.94 0.8 Allowed 'Trans proline' 0 N--CA 1.447 -1.216 0 C-N-CA 123.01 2.473 . . . . 0.0 111.512 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.765 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -65.73 -34.11 87.89 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.456 -0.878 . . . . 0.0 110.931 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.809 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -176.01 -136.64 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.228 -0.986 . . . . 0.0 108.638 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -121.8 -52.62 2.0 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 173.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.633 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 3.1 m -54.8 95.42 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.734 -1.575 . . . . 0.0 110.221 171.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.522 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 42.0 tp10 -41.14 -58.0 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -168.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.873 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -60.49 -52.36 62.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.131 0.491 . . . . 0.0 111.191 -175.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HA ' HD21 ' A' ' 55' ' ' LEU . 3.0 t -62.49 -35.73 80.27 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.495 177.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.563 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 3.3 ttmt -56.46 -52.74 63.57 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.795 177.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.5 ' N ' ' HG2' ' A' ' 15' ' ' LYS . 55.2 mm-40 -56.57 -48.94 76.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.628 178.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -57.37 -50.44 72.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.747 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.862 HD11 ' HB2' ' A' ' 87' ' ' CYS . 98.0 mt -58.83 -55.93 28.72 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -175.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.765 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 21.6 t-20 -66.23 -39.86 89.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.684 0.278 . . . . 0.0 111.311 -171.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 -68.05 -36.38 79.79 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.697 0.284 . . . . 0.0 110.557 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.94 -46.45 68.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.805 0.812 . . . . 0.0 109.427 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.669 ' HE2' ' HG2' ' A' ' 1' ' ' GLN . 86.1 t80 -48.48 -52.88 20.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.521 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.631 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -74.4 -36.38 63.49 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.631 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 72.2 m -63.73 -31.81 73.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 25' ' ' LEU . 1.1 tp -75.84 -24.01 55.78 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.768 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 22' ' ' TYR . 45.2 mm -84.07 -37.09 12.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -56.35 -54.9 40.07 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.249 172.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -78.23 -20.5 51.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.838 -177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.73 28.37 70.94 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.406 -0.426 . . . . 0.0 113.285 174.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.549 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.0 OUTLIER -100.1 9.93 7.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 122.402 1.096 . . . . 0.0 110.073 -176.332 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.49 ' ND2' HD23 ' A' ' 25' ' ' LEU . 2.4 t-20 -88.45 8.33 28.44 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.991 -1.459 . . . . 0.0 112.388 -164.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -108.14 8.4 28.03 Favored 'General case' 0 C--N 1.315 -0.903 0 O-C-N 121.736 -0.603 . . . . 0.0 110.48 -177.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.476 ' O ' HG13 ' A' ' 37' ' ' ILE . 14.8 m -124.94 118.72 26.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.002 175.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -62.03 -41.17 97.82 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.268 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -66.1 -29.29 69.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.583 0.706 . . . . 0.0 109.767 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.9 m -76.59 -42.75 41.43 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.522 179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 33' ' ' SER . 73.0 mt -58.12 -34.96 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.448 ' O ' HG13 ' A' ' 42' ' ' ILE . 35.7 tt0 -63.86 -52.32 60.58 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.834 178.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -67.5 -36.22 80.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.071 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.549 ' HG3' HG21 ' A' ' 30' ' ' VAL . 8.5 mm-40 -67.36 -38.16 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.382 178.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 20.1 tp -60.28 -36.39 77.72 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 38' ' ' GLU . 85.9 mt -67.79 -50.54 59.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.714 175.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.7 m -59.39 -42.77 92.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.408 -179.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -69.35 -32.79 72.09 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.153 0.501 . . . . 0.0 109.837 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 2.2 t -68.29 -31.87 71.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.327 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.5 tp -85.27 -30.97 23.36 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.266 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -97.1 51.99 1.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.823 0.82 . . . . 0.0 110.551 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.7 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -141.93 -170.13 3.07 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.23 178.073 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.492 ' HD2' ' N ' ' A' ' 49' ' ' LYS . 10.8 mptt -97.16 166.12 11.73 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.536 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.32 -43.29 19.36 Favored Glycine 0 C--N 1.329 0.187 0 O-C-N 123.876 0.735 . . . . 0.0 114.471 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.427 ' HD3' ' HA ' ' A' ' 51' ' ' LYS . 0.2 OUTLIER -61.55 -36.33 80.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.103 0.477 . . . . 0.0 110.716 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.3 mt-10 -85.09 -34.76 22.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.158 -176.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -60.27 -43.31 96.3 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 23.2 tpt180 -72.25 -35.2 68.74 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.488 177.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.873 HD22 HG12 ' A' ' 13' ' ' VAL . 57.8 tp -56.35 -39.05 72.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.384 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.697 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -71.28 -15.07 62.41 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.139 -176.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.1 m-85 -66.32 -34.23 77.51 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.163 0.506 . . . . 0.0 109.665 174.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 97' ' ' ILE . 24.1 m-85 -83.3 -23.77 32.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.712 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.507 ' CD2' HD11 ' A' ' 97' ' ' ILE . 22.5 mt -79.38 -19.33 50.38 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.15 173.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.608 ' HA2' ' HB3' ' A' ' 65' ' ' ALA . . . 92.78 0.32 69.16 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.92 -0.582 . . . . 0.0 113.475 175.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.574 ' HB2' ' HG ' ' A' ' 41' ' ' LEU . . . -60.95 -33.73 73.64 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -172.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.697 HG23 ' SG ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -74.26 -8.37 56.0 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -174.403 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm 68.69 -7.16 0.75 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.145 0.578 . . . . 0.0 111.403 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 62' ' ' THR . 19.6 t70 -72.03 -23.96 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.863 0.84 . . . . 0.0 109.245 175.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.608 ' HB3' ' HA2' ' A' ' 60' ' ' GLY . . . -90.94 -167.52 1.84 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.69 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.652 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -62.84 133.29 54.49 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.091 175.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -77.56 -21.3 52.72 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -77.85 -26.26 49.26 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.035 -0.266 . . . . 0.0 110.949 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' ' 66' ' ' ALA . 15.0 pt -76.35 -22.87 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.431 0 CA-C-O 120.964 0.411 . . . . 0.0 110.203 179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.34 -48.68 72.16 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.71 ' O ' ' HG2' ' A' ' 75' ' ' ARG . 18.9 m -63.16 -34.17 77.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.218 174.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.431 ' HB3' ' O ' ' A' ' 69' ' ' ILE . 12.4 tp10 -53.74 -33.52 55.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.236 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 57.3 t -86.69 -53.57 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.324 175.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.62 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 41.8 p -58.92 -33.56 70.71 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -172.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.71 ' HG2' ' O ' ' A' ' 71' ' ' SER . 21.6 mmt180 -64.43 -57.45 17.29 Favored Pre-proline 0 CA--C 1.536 0.422 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.214 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.539 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 49.3 Cg_endo -71.11 -15.62 32.07 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.857 1.704 . . . . 0.0 112.74 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.8 mmt -73.05 -19.98 61.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.419 177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.43 ' HA ' HD11 ' A' ' 37' ' ' ILE . 23.5 t -61.78 -13.61 25.27 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -174.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.789 HG13 ' HG3' ' A' ' 81' ' ' MET . 13.3 p -153.48 148.26 13.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -48.07 111.83 0.49 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.041 0.448 . . . . 0.0 110.424 176.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.789 ' HG3' HG13 ' A' ' 79' ' ' VAL . 21.6 mtp -144.7 178.98 1.26 Allowed Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -166.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.591 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 33.8 Cg_exo -37.43 1.68 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.189 1 C-N-CA 127.92 5.747 . . . . 0.0 118.535 170.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.623 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -37.28 -38.35 0.22 Allowed 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.838 1.199 . . . . 0.0 113.892 -170.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.809 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.5 OUTLIER -51.76 -50.33 60.85 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.939 0.4 . . . . 0.0 111.128 176.313 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.67 ' H ' ' HG2' ' A' ' 84' ' ' MET . 6.3 ptmt -88.2 -14.63 38.08 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.237 -0.29 . . . . 0.0 111.377 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.623 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 31.2 mt -59.71 -44.1 92.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.614 0.245 . . . . 0.0 110.846 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.862 ' HB2' HD11 ' A' ' 18' ' ' LEU . 42.6 t -65.89 -21.13 66.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.276 0.56 . . . . 0.0 111.211 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -82.88 -34.71 26.64 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 60.0 mttt -62.67 -31.42 72.3 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.478 0.656 . . . . 0.0 109.812 172.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 87' ' ' CYS . 74.1 mt -66.74 -14.8 63.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.951 -177.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 41.7 mtpt -67.2 -17.49 64.84 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.698 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -66.15 -29.77 70.12 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.563 . . . . 0.0 109.689 174.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 60.1 mt -90.42 -50.22 6.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.101 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 16.6 t70 -147.71 132.42 17.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.067 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 16.3 m -87.44 -20.79 26.12 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.424 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.1 tp60 -78.89 -30.12 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.679 0.276 . . . . 0.0 110.739 -174.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.531 ' HB ' ' HB3' ' A' ' 58' ' ' TYR . 10.3 tt -54.25 -29.18 19.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.854 0.835 . . . . 0.0 110.109 173.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.633 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 45.1 t -86.3 -58.71 2.52 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.624 -178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -96.17 42.89 1.08 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.798 -173.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 22.2 tp -70.57 -56.63 6.07 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.956 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp 69.38 135.28 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 O-C-N 124.122 0.889 . . . . 0.0 112.016 177.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -68.2 157.76 34.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.683 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -83.0 75.37 9.89 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.398 0.618 . . . . 0.0 110.549 -177.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HG2' ' H ' ' A' ' 104' ' ' LYS . 14.3 pttp -74.86 46.83 0.31 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.393 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 39.5 p . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.765 -0.636 . . . . 0.0 110.079 -178.81 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.62 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 0.2 OUTLIER -165.17 153.9 12.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.822 -166.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.79 ' HB3' ' HA ' ' A' ' 16' ' ' GLU . . . -121.16 1.99 10.34 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 120.846 0.355 . . . . 0.0 110.487 176.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -65.2 105.99 1.38 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.469 176.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 106.07 -12.33 44.85 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.466 -175.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.437 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 41.1 mtt-85 -97.42 165.97 14.61 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -85.87 73.23 3.8 Favored 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.815 2.344 . . . . 0.0 109.999 175.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.952 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -78.65 -39.87 20.03 Favored Glycine 0 N--CA 1.441 -1.016 0 C-N-CA 120.091 -1.052 . . . . 0.0 112.4 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HB1' ' CB ' ' A' ' 87' ' ' CYS . . . -173.67 -90.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.834 0.35 . . . . 0.0 110.347 -176.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -152.58 -71.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.584 ' HB2' ' O ' ' A' ' 98' ' ' CYS . 1.4 m -81.18 146.52 30.46 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -46.78 -56.79 5.65 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -171.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.836 HG12 HD22 ' A' ' 55' ' ' LEU . 58.7 t -61.13 -50.98 78.28 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 117.958 0.345 . . . . 0.0 111.742 -173.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HA ' HD21 ' A' ' 55' ' ' LEU . 49.9 t -60.62 -33.87 73.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.525 0.678 . . . . 0.0 109.913 176.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.81 ' HG3' ' HA3' ' A' ' 8' ' ' GLY . 24.0 ttmt -67.17 -48.8 66.88 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.282 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.79 ' HA ' ' HB3' ' A' ' 3' ' ' ALA . 1.5 mm-40 -57.67 -42.93 84.59 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.843 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -66.35 -57.01 8.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.218 -176.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 80.0 mt -67.18 -39.05 86.35 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 120.719 -0.392 . . . . 0.0 111.157 -173.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.952 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 27.3 t-20 -68.7 -55.9 9.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -176.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.62 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 67.1 mtm180 -64.28 -32.95 74.75 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.433 0.161 . . . . 0.0 111.433 -178.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -64.12 -47.28 80.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.982 0.896 . . . . 0.0 109.622 174.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 49.8 t80 -57.96 -55.94 28.43 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 113.575 -1.648 . . . . 0.0 111.868 -177.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -71.46 -26.84 62.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.259 -176.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.41 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 46.1 t -65.91 -47.56 74.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.923 0.392 . . . . 0.0 110.2 176.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.7 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -60.07 -48.37 82.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.605 -179.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 22' ' ' TYR . 43.3 mm -62.2 -45.51 98.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.702 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -70.75 -38.13 73.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.374 -177.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.479 ' HB2' HG12 ' A' ' 30' ' ' VAL . 60.0 mtm180 -76.32 -13.64 60.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.86 0.362 . . . . 0.0 111.726 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.51 38.31 57.85 Favored Glycine 0 N--CA 1.449 -0.486 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.7 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 1.9 p -125.07 91.31 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.795 0 CA-C-N 115.295 -0.452 . . . . 0.0 110.042 -176.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -168.88 -170.29 1.14 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.026 178.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 62.38 35.11 15.17 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.605 ' O ' HG12 ' A' ' 37' ' ' ILE . 47.2 m -155.28 101.15 2.2 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 176.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.483 HD11 ' HD2' ' A' ' 75' ' ' ARG . 3.2 mm? -47.16 -43.94 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -174.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -58.16 -46.63 85.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.449 0.642 . . . . 0.0 110.458 177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 60.6 m -71.14 -35.48 71.71 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.673 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 33' ' ' SER . 14.9 mm -55.4 -34.27 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 121.089 0.471 . . . . 0.0 109.73 178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -61.36 -47.79 84.26 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.914 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -66.63 -36.78 83.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.097 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -60.94 -53.28 59.15 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.6 OUTLIER -57.42 -41.26 80.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.67 0.271 . . . . 0.0 110.692 177.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 77.8 mt -65.01 -44.89 95.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.592 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.2 m -58.74 -46.32 87.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.024 0.44 . . . . 0.0 110.34 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.4 t80 -76.12 -17.45 59.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.597 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.6 t -69.01 -47.83 64.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.835 177.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 46' ' ' LEU . 3.8 mm? -86.47 -31.22 21.47 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -72.09 -22.88 61.28 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.04 -164.29 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -98.62 173.11 7.08 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.305 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.89 -47.23 39.89 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 114.659 0.623 . . . . 0.0 114.659 -169.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.522 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 13.9 mptt -60.9 -37.06 80.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 117.153 0.476 . . . . 0.0 110.967 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.753 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 30.6 mt-10 -81.61 -34.79 30.71 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.888 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.434 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 7.1 m120 -65.94 -23.9 66.7 Favored 'General case' 0 C--O 1.226 -0.174 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 176.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 57' ' ' TYR . 9.2 tpp180 -86.92 -35.04 19.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.235 0.54 . . . . 0.0 109.694 172.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.836 HD22 HG12 ' A' ' 13' ' ' VAL . 29.8 tp -60.99 -36.39 79.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.333 -179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.639 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 21.6 p -65.72 -20.29 66.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.332 -178.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 45.7 m-85 -68.64 -30.94 69.76 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.506 ' HB3' HG13 ' A' ' 97' ' ' ILE . 91.0 m-85 -85.3 -45.24 12.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.53 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.6 HD23 HD11 ' A' ' 97' ' ' ILE . 88.9 mt -68.7 -12.61 61.62 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.564 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.859 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 77.04 40.49 24.87 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.095 178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.639 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -107.57 25.1 11.9 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.613 0.721 . . . . 0.0 110.281 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.1 t -149.03 141.76 24.54 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.295 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -80.04 -3.22 47.64 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.475 -174.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -92.88 7.95 41.73 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.62 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.16 -161.65 1.11 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -54.78 109.97 0.58 Allowed 'General case' 0 C--N 1.332 -0.175 0 O-C-N 123.443 0.464 . . . . 0.0 109.964 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -83.43 -15.27 50.32 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.343 -173.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -66.5 -44.71 81.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.853 0.358 . . . . 0.0 110.568 177.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.859 HG23 ' HA3' ' A' ' 60' ' ' GLY . 16.7 tt -72.29 -21.52 20.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.756 -177.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.1 tt -61.15 -46.9 88.63 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 171.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.485 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 8.6 m -66.36 -28.51 68.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.719 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.437 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 8.5 mm-40 -67.65 -58.26 4.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.708 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.587 ' O ' ' HB2' ' A' ' 77' ' ' MET . 60.9 t -62.32 -44.29 99.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.798 0.333 . . . . 0.0 111.6 -173.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.473 ' HA ' HG21 ' A' ' 37' ' ' ILE . 16.4 p -56.59 -32.56 65.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -176.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.485 ' HD3' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -61.32 -56.75 30.89 Favored Pre-proline 0 CA--C 1.535 0.4 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.267 -175.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.942 ' HB2' ' HG2' ' A' ' 81' ' ' MET . 72.6 Cg_endo -78.77 -27.49 4.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 121.706 1.604 . . . . 0.0 113.444 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.587 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 0.3 OUTLIER -67.21 -19.21 65.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.801 0.334 . . . . 0.0 110.795 -178.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 32.8 t -68.34 -13.36 62.22 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.547 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.699 HG22 ' H ' ' A' ' 80' ' ' HIS . 5.9 p -129.23 179.25 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -178.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.699 ' H ' HG22 ' A' ' 79' ' ' VAL . 14.9 t-80 -55.02 -67.86 0.24 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 122.501 0.32 . . . . 0.0 110.226 -178.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.942 ' HG2' ' HB2' ' A' ' 76' ' ' PRO . 15.4 tpt 67.39 145.71 0.1 Allowed Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 164.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.863 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 42.5 Cg_exo -43.74 4.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.484 0.949 1 C-N-CA 127.661 5.574 . . . . 0.0 118.251 168.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.607 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.21 -31.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 116.895 2.183 . . . . 0.0 116.895 -158.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.83 ' SD ' ' HG3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -65.75 -45.18 83.56 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 120.028 1.285 . . . . 0.0 109.997 175.239 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.83 ' HG3' ' SD ' ' A' ' 84' ' ' MET . 90.1 mttt -63.82 -24.2 67.66 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.148 176.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.775 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 32.7 mt -61.76 -27.38 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.896 -174.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.722 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 18.6 t -75.59 -31.56 59.99 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.57 176.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.537 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 4.5 mm-40 -63.35 -43.24 98.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.185 173.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.775 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 0.0 OUTLIER -68.57 -33.94 74.95 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.415 176.084 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 87' ' ' CYS . 15.5 mt -64.3 -31.43 72.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.283 177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 54.2 mtpt -67.33 -17.13 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.072 0.463 . . . . 0.0 110.854 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.423 ' HB3' ' O ' ' A' ' 89' ' ' LYS . 58.0 tttm -76.69 -25.53 53.73 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.772 175.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -88.65 -52.54 5.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.736 175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.662 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 11.7 t70 -139.49 134.19 31.93 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.051 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 35.7 m -85.71 -30.36 23.21 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -86.27 -14.82 42.63 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -173.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.6 HD11 HD23 ' A' ' 59' ' ' LEU . 14.5 tt -59.7 -27.61 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.235 0.54 . . . . 0.0 111.027 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 45.4 t -83.12 -30.93 27.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.679 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -75.28 -94.95 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.398 -171.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.64 -68.28 0.12 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.544 0.528 . . . . 0.0 110.582 -171.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.498 ' HB2' ' HD3' ' A' ' 104' ' ' LYS . 33.4 mmtp 64.24 117.32 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.668 0.747 . . . . 0.0 111.81 177.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.522 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 89.5 m-85 -59.95 -53.11 61.69 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.894 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -133.14 145.13 50.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.049 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.498 ' HD3' ' HB2' ' A' ' 101' ' ' LYS . 15.8 pttm -156.89 20.34 0.32 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.412 0.625 . . . . 0.0 110.402 -179.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.5 t . . . . . 0 C--O 1.25 1.09 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.371 176.955 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.799 ' HA ' ' HD2' ' A' ' 20' ' ' ARG . 4.2 pt20 . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.829 ' HA ' ' HD2' ' A' ' 6' ' ' ARG . 8.4 tp10 73.4 146.83 0.08 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 123.854 0.721 . . . . 0.0 111.365 175.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.8 47.39 0.49 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.9 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 72.45 58.47 4.99 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.602 -177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 73.51 55.25 6.18 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -173.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.829 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -43.0 105.86 0.45 Allowed Pre-proline 0 N--CA 1.463 0.192 0 CA-C-O 121.984 0.897 . . . . 0.0 112.691 -170.754 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.613 ' O ' ' HB3' ' A' ' 84' ' ' MET . 56.7 Cg_endo -89.65 63.46 2.21 Favored 'Trans proline' 0 N--CA 1.443 -1.446 0 C-N-CA 123.228 2.619 . . . . 0.0 110.184 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.644 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -73.77 -27.8 66.33 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.119 -176.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 87' ' ' CYS . . . 177.78 -125.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 O-C-N 124.028 0.487 . . . . 0.0 110.624 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -128.41 -63.56 0.98 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.411 ' HB3' ' HA ' ' A' ' 99' ' ' GLU . 18.9 m -70.17 124.66 24.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.243 171.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 3.0 mp0 -46.28 -49.16 17.77 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -169.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.912 HG12 HD22 ' A' ' 55' ' ' LEU . 61.5 t -70.11 -46.81 71.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -167.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 12.7 p -66.47 -30.08 70.34 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.644 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 19.6 ttmt -61.27 -54.7 40.72 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.6 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.631 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 59.9 mm-40 -52.22 -52.29 53.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.081 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -58.8 -55.4 35.56 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.771 -176.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.425 HD12 ' HB2' ' A' ' 87' ' ' CYS . 85.6 mt -63.07 -44.15 96.58 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.991 -172.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.544 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.2 t-20 -65.61 -49.04 70.18 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 123.143 0.277 . . . . 0.0 111.538 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.799 ' HD2' ' HA ' ' A' ' 1' ' ' GLN . 10.5 mtm180 -71.33 -35.89 71.37 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.714 -175.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -64.18 -44.09 93.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.487 0.66 . . . . 0.0 109.497 174.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.521 ' O ' HG12 ' A' ' 26' ' ' ILE . 66.7 t80 -54.81 -55.54 29.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.377 177.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -70.73 -27.63 64.1 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.764 -0.375 . . . . 0.0 110.972 -178.089 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.477 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 51.4 m -63.37 -52.87 59.88 Favored 'General case' 0 C--O 1.217 -0.622 0 CA-C-N 116.712 -0.222 . . . . 0.0 110.744 176.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.75 HD23 HD22 ' A' ' 31' ' ' ASN . 3.1 mp -60.69 -36.59 79.17 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.484 0.183 . . . . 0.0 111.38 -179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.521 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.4 mm -67.63 -52.53 39.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.72 177.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -70.83 -35.01 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.664 -176.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.619 ' HB2' HG12 ' A' ' 30' ' ' VAL . 64.2 mtp180 -75.06 -14.49 60.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.021 0.439 . . . . 0.0 111.242 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.66 40.12 85.89 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.526 -0.629 . . . . 0.0 111.526 -177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.681 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 3.4 p -127.42 56.48 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.753 0 CA-C-O 122.519 1.152 . . . . 0.0 110.13 -173.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.75 HD22 HD23 ' A' ' 25' ' ' LEU . 12.8 t-20 -143.68 -163.64 1.7 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.583 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.453 ' H ' ' CG ' ' A' ' 31' ' ' ASN . 94.1 m-85 60.73 30.14 19.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.512 0.673 . . . . 0.0 110.879 -176.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.51 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 32.7 m -153.15 112.84 3.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.745 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.2 mm? -61.85 -41.28 97.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.34 -172.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.48 -27.29 64.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.153 0.501 . . . . 0.0 110.389 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.51 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.0 m -73.88 -45.97 47.58 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.747 178.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 33' ' ' SER . 45.0 mt -61.32 -34.3 60.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -73.41 -25.52 60.57 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.375 -178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -85.6 -44.86 12.26 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.063 0.458 . . . . 0.0 110.263 176.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -65.89 -35.77 81.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.596 -176.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.778 HD13 HD11 ' A' ' 70' ' ' LEU . 16.4 mt -55.96 -40.05 72.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.273 0.559 . . . . 0.0 109.645 172.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 51.4 mt -72.72 -38.39 58.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.397 -177.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 t -75.25 -50.78 15.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.969 0.414 . . . . 0.0 110.73 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -62.83 -30.92 71.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.027 -175.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 15.6 m -68.07 -27.85 66.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -89.18 -15.18 34.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.218 0.532 . . . . 0.0 110.507 173.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -80.32 -22.2 41.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.534 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.782 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -76.94 -168.18 1.01 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.813 179.231 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.1 mttp -93.84 167.97 11.29 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.32 -46.53 35.53 Favored Glycine 0 CA--C 1.517 0.197 0 O-C-N 123.662 0.601 . . . . 0.0 114.442 -171.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.4 ' HD2' ' HB3' ' A' ' 100' ' ' LEU . 16.7 tppt? -59.35 -38.79 81.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 117.146 0.473 . . . . 0.0 110.33 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.782 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 23.5 mt-10 -80.37 -36.49 33.92 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.204 -176.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -59.28 -47.79 84.04 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 174.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -68.13 -37.5 81.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.48 178.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.912 HD22 HG12 ' A' ' 13' ' ' VAL . 33.8 tp -52.72 -38.6 61.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.088 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 68.5 m -71.87 -15.04 62.11 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -73.19 -23.11 60.37 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.497 ' HB3' HG13 ' A' ' 97' ' ' ILE . 89.4 m-85 -85.33 -46.7 10.72 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.55 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.859 ' HA ' HD11 ' A' ' 97' ' ' ILE . 86.9 mt -62.21 -24.66 67.36 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.702 -178.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.76 7.11 61.72 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.626 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.407 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -90.49 59.85 4.43 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.451 0.643 . . . . 0.0 110.822 -178.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.3 t -166.11 146.93 6.57 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.449 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -87.2 24.42 1.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.527 0.68 . . . . 0.0 110.445 -176.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -125.72 13.83 8.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.205 174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -141.46 -176.0 4.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.721 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 69' ' ' ILE . . . -73.89 88.78 1.84 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.965 0.412 . . . . 0.0 111.155 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -18.84 65.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.801 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -61.28 -21.72 64.2 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.798 0.295 . . . . 0.0 111.798 -178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 66' ' ' ALA . 10.9 pt -85.44 -14.48 10.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.089 0.471 . . . . 0.0 110.48 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.778 HD11 HD13 ' A' ' 41' ' ' LEU . 21.8 tp -69.88 -15.42 63.07 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.876 -171.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.416 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 2.8 p -61.12 -29.66 69.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.535 174.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 58.6 mm-40 -63.47 -29.11 70.44 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.387 178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.477 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 60.2 t -88.41 -56.79 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.192 0.52 . . . . 0.0 111.122 177.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.416 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 6.6 p -53.14 -47.83 68.39 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.244 -0.889 . . . . 0.0 113.283 -172.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.585 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.4 mpt_? -65.09 -51.78 52.91 Favored Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -174.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.7 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 45.9 Cg_exo -61.76 -34.96 81.89 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 121.549 1.499 . . . . 0.0 113.247 175.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 21.0 mmt -68.08 -13.55 62.29 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.2 t -67.7 -13.47 62.12 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -175.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.516 HG13 ' H ' ' A' ' 80' ' ' HIS . 2.8 p -134.77 -62.23 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.516 ' H ' HG13 ' A' ' 79' ' ' VAL . 12.7 t-80 -176.33 -89.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -173.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.7 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 49.5 mtp 68.11 167.56 0.12 Allowed Pre-proline 0 CA--C 1.539 0.554 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 163.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 4.9 Cg_endo -44.92 4.02 0.01 OUTLIER 'Trans proline' 0 C--O 1.205 -1.151 1 C-N-CA 127.987 5.791 . . . . 0.0 117.969 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -34.6 -26.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 118.249 2.685 . . . . 0.0 118.249 -148.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.624 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -54.21 -42.98 70.4 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 120.471 1.487 . . . . 0.0 109.744 166.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.761 ' HB3' ' HB2' ' A' ' 82' ' ' PRO . 23.9 ttmm -71.1 -17.71 62.57 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.966 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.551 HD12 ' HA ' ' A' ' 83' ' ' ALA . 66.9 mt -64.84 -25.39 37.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.414 -179.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.6 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 51.0 t -80.32 -30.58 38.15 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.59 173.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -65.53 -40.65 93.19 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 8.1 tppt? -57.96 -47.51 82.71 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.74 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.6 ' HB3' HD13 ' A' ' 97' ' ' ILE . 16.4 mt -65.67 -24.56 67.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.45 -0.795 . . . . 0.0 112.055 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.6 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 39.8 mtpt -69.99 -14.99 62.96 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.834 -177.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 34.9 pttt -73.94 -22.75 59.55 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.189 -0.605 . . . . 0.0 109.405 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 94.5 mt -87.92 -45.88 9.87 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.913 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.598 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 10.5 t70 -142.46 138.02 30.72 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.689 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.2 m -87.02 -28.04 22.85 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -175.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -85.88 -14.23 45.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.114 0.483 . . . . 0.0 110.911 -175.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.859 HD11 ' HA ' ' A' ' 59' ' ' LEU . 18.8 tt -55.02 -27.21 18.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.48 -0.782 . . . . 0.0 113.089 -175.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 14' ' ' CYS . 15.8 p -85.39 -38.88 18.21 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -169.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.677 ' HG3' ' H ' ' A' ' 100' ' ' LEU . 6.5 pt-20 -79.58 -98.43 0.03 OUTLIER 'General case' 0 C--O 1.223 -0.33 0 C-N-CA 120.437 -0.505 . . . . 0.0 112.121 -170.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.677 ' H ' ' HG3' ' A' ' 99' ' ' GLU . 94.5 mt 53.86 42.23 31.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 117.841 0.292 . . . . 0.0 110.326 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.476 ' HB3' ' N ' ' A' ' 105' ' ' THR . 34.7 mmtp -49.64 134.98 19.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.53 -174.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -61.86 -68.18 0.34 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.0 110.556 -177.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -116.03 54.01 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.329 -0.85 . . . . 0.0 109.267 -177.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER 68.44 2.93 3.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.199 -169.704 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.476 ' N ' ' HB3' ' A' ' 101' ' ' LYS . 15.2 t . . . . . 0 C--O 1.246 0.889 0 CA-C-N 114.997 -1.001 . . . . 0.0 108.374 -178.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 120.057 -0.02 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.407 ' HG3' HH21 ' A' ' 6' ' ' ARG . 8.8 pt-20 179.66 141.25 0.13 Allowed 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 111.093 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.412 ' HB1' ' O ' ' A' ' 6' ' ' ARG . . . -87.56 -70.76 0.6 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 167.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 56.37 -103.43 0.26 Allowed Glycine 0 C--N 1.333 0.383 0 C-N-CA 121.346 -0.454 . . . . 0.0 112.47 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -65.42 -22.92 69.87 Favored Glycine 0 N--CA 1.452 -0.278 0 N-CA-C 111.766 -0.534 . . . . 0.0 111.766 175.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.46 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 59.4 mtm-85 -85.73 137.44 36.0 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-O 120.832 0.349 . . . . 0.0 110.062 175.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 36.6 Cg_endo -97.48 105.41 0.08 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.417 0 C-N-CA 123.824 3.016 . . . . 0.0 111.317 -176.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.518 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -90.32 -32.46 9.56 Favored Glycine 0 N--CA 1.436 -1.301 0 C-N-CA 119.111 -1.519 . . . . 0.0 111.733 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.72 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -166.21 -81.54 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.892 0.377 . . . . 0.0 110.232 -177.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -176.48 -47.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.825 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 5.7 p -66.21 -90.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.357 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 31.2 tt0 -172.45 -81.68 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.926 HG12 HD22 ' A' ' 55' ' ' LEU . 36.4 t -56.86 -45.08 83.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.871 0.367 . . . . 0.0 111.488 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 49.5 t -64.69 -35.42 80.97 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.852 177.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 13.3 ptpt -71.82 -37.73 70.28 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 121.108 0.48 . . . . 0.0 109.717 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.582 ' O ' ' HB2' ' A' ' 20' ' ' ARG . 78.2 mm-40 -58.82 -51.31 70.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.335 178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -62.38 -55.63 26.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.572 -176.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.497 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 86.5 mt -59.79 -43.19 94.54 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.62 0.248 . . . . 0.0 111.506 -174.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 14.4 t-20 -74.76 -44.01 51.9 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.865 -176.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.582 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 7.0 tpp85 -55.2 -51.2 67.32 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.271 0.557 . . . . 0.0 110.158 175.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' CD2' ' SD ' ' A' ' 77' ' ' MET . 29.6 t80 -59.57 -42.63 92.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.659 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.2 OUTLIER -52.96 -57.01 11.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.513 178.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.505 ' HD3' ' N ' ' A' ' 24' ' ' SER . 0.0 OUTLIER -76.18 -30.94 58.26 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.755 -173.662 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 4.8 t -68.34 -36.73 79.7 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.937 0.399 . . . . 0.0 110.288 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.733 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 0.7 OUTLIER -67.21 -42.95 83.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.43 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.522 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -63.69 -43.31 98.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.085 175.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -55.86 -55.53 31.38 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.085 0.469 . . . . 0.0 110.777 177.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 30.4 mtm-85 -66.78 -17.35 64.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.163 -177.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.51 31.52 33.32 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.583 179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.733 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -131.04 100.69 4.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.111 -0.545 . . . . 0.0 110.074 -175.109 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -168.8 -170.58 1.2 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.9 t80 73.9 -49.57 0.68 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.784 0.834 . . . . 0.0 111.545 176.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 3.9 m -66.95 114.99 6.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.942 0.401 . . . . 0.0 110.317 177.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.693 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -58.39 -45.15 88.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.983 -176.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -28.52 69.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.266 0.555 . . . . 0.0 110.431 -179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.496 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 90.3 m -79.78 -45.49 18.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.524 -178.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' SER . 37.4 mt -60.11 -27.93 40.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -64.12 -41.53 97.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.773 177.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 18.8 mmmt -74.22 -45.52 47.66 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.686 0.755 . . . . 0.0 109.981 -179.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -66.92 -33.45 75.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.743 -1.117 . . . . 0.0 111.769 -174.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' HB2' ' A' ' 61' ' ' ALA . 24.2 tp -59.8 -29.24 68.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.551 ' HA ' ' SG ' ' A' ' 45' ' ' CYS . 81.4 mt -84.48 -50.5 14.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.297 175.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -55.42 -37.93 68.32 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.981 -178.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -71.63 -33.81 69.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.721 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.551 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 26.6 p -85.41 -13.46 49.28 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 119.926 -0.709 . . . . 0.0 111.52 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 65.8 tp -86.58 -22.17 26.43 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.191 0.519 . . . . 0.0 110.193 170.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -81.99 -23.22 36.13 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.041 179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -79.89 -172.32 3.32 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.542 -175.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 52.2 mttp -99.23 173.85 6.59 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.853 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.14 -41.38 38.39 Favored Glycine 0 C--N 1.332 0.308 0 N-CA-C 114.993 0.757 . . . . 0.0 114.993 -169.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.47 ' HE3' ' HA ' ' A' ' 102' ' ' TYR . 14.9 tppt? -60.81 -43.54 98.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 0.0 109.955 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 19.1 mt-10 -80.45 -32.5 37.22 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.58 -174.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -61.63 -52.49 64.15 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -63.28 -35.63 81.0 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.486 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.926 HD22 HG12 ' A' ' 13' ' ' VAL . 52.1 tp -56.52 -33.57 66.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.029 177.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.793 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 51.3 t -70.67 -25.32 62.93 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.378 -177.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.531 ' CZ ' HG21 ' A' ' 62' ' ' THR . 64.3 m-85 -69.05 -28.14 66.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.207 0.527 . . . . 0.0 109.708 174.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.548 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.1 m-85 -86.83 -34.27 19.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.926 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 90.3 mt -71.51 -14.87 62.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.826 177.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.579 ' HA3' HD11 ' A' ' 69' ' ' ILE . . . 91.22 11.85 60.71 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.899 -0.667 . . . . 0.0 113.744 171.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.793 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -84.02 -43.29 15.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.006 0.403 . . . . 0.0 111.107 -178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.531 HG21 ' CZ ' ' A' ' 57' ' ' TYR . 1.2 m -64.65 154.41 36.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.789 -178.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -80.3 49.18 1.09 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.901 0.381 . . . . 0.0 111.659 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -162.86 46.01 0.14 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 174.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.414 ' CB ' ' HA2' ' A' ' 60' ' ' GLY . . . -148.79 -167.77 2.92 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.169 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.9 123.17 21.37 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 176.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.6 p -76.34 -29.82 57.39 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -173.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -84.85 -29.75 25.05 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.579 HD11 ' HA3' ' A' ' 60' ' ' GLY . 24.2 pt -68.17 -16.89 21.61 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 120.758 0.313 . . . . 0.0 111.287 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 70' ' ' LEU . 3.0 tt -63.23 -37.98 89.37 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.9 m -68.39 -24.59 64.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.667 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -68.07 -24.93 65.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.009 178.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.499 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 59.0 t -87.57 -57.71 4.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.955 0.407 . . . . 0.0 110.937 175.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.416 HG22 ' CG2' ' A' ' 37' ' ' ILE . 12.4 p -54.61 -54.97 34.48 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -173.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.693 ' HA ' HD11 ' A' ' 34' ' ' LEU . 9.3 mpt_? -54.4 -50.9 82.45 Favored Pre-proline 0 CA--C 1.534 0.348 0 O-C-N 123.234 0.334 . . . . 0.0 111.867 -174.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.499 ' HD2' ' O ' ' A' ' 73' ' ' VAL . 32.3 Cg_exo -64.96 -45.39 8.11 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 121.33 1.353 . . . . 0.0 112.707 173.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.429 ' SD ' ' CD2' ' A' ' 21' ' ' PHE . 53.5 ttm -65.25 -13.19 57.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.79 0.329 . . . . 0.0 111.812 -175.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.1 m -58.66 -19.25 37.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.726 175.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.465 HG13 ' HG2' ' A' ' 81' ' ' MET . 10.7 p -141.53 167.65 16.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 174.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -70.05 110.02 4.88 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.883 -0.51 . . . . 0.0 110.15 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.753 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 21.9 mmm -130.31 172.94 6.42 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -167.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.753 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.7 Cg_exo -39.19 1.89 0.0 OUTLIER 'Trans proline' 0 N--CA 1.482 0.824 1 C-N-CA 127.89 5.727 . . . . 0.0 118.68 171.032 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.578 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -39.83 -26.09 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 116.226 1.935 . . . . 0.0 116.226 -168.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.72 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -57.17 -41.3 79.0 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 122.129 0.966 . . . . 0.0 109.269 172.045 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 29.5 mtpt -85.26 -22.55 28.58 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.476 -1.238 . . . . 0.0 111.078 178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.578 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 58.8 mt -66.93 -33.26 62.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 C-N-CA 120.399 -0.521 . . . . 0.0 109.878 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.497 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 34.6 t -62.63 -31.97 72.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.187 0.518 . . . . 0.0 110.299 173.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.661 ' HA ' ' HG3' ' A' ' 91' ' ' LYS . 33.8 tt0 -68.5 -34.82 76.56 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.684 177.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.213 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.28 -42.53 30.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.416 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.661 ' HG3' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -69.75 -13.77 62.45 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.819 0.342 . . . . 0.0 110.642 179.822 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -59.72 -37.75 79.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.157 0.503 . . . . 0.0 109.744 170.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.0 -46.52 18.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.815 176.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.592 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 15.2 t70 -142.34 108.16 5.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.939 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.615 ' HA ' ' HB2' ' A' ' 91' ' ' LYS . 13.0 t -73.48 -17.0 61.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.209 -175.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.421 ' HB2' ' OD1' ' A' ' 94' ' ' ASP . 23.8 mt-30 -67.8 -20.14 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.64 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.548 HG12 ' HB3' ' A' ' 58' ' ' TYR . 84.0 mt -56.79 -48.84 80.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 121.575 0.702 . . . . 0.0 110.26 173.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -79.49 -48.87 13.15 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.814 -177.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -87.58 37.64 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.039 -176.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.656 HD23 HG11 ' A' ' 13' ' ' VAL . 21.3 tp -74.05 -57.18 4.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 177.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.7 mmtp 65.13 122.45 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.207 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.47 ' HA ' ' HE3' ' A' ' 51' ' ' LYS . 96.6 m-85 -61.3 -60.36 3.86 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.269 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 104' ' ' LYS . 47.3 mm-40 -101.13 -70.09 0.75 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 176.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 103' ' ' GLU . 2.6 tppp? 172.77 127.43 0.02 OUTLIER 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 114.861 -1.063 . . . . 0.0 109.597 177.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.749 -0.644 . . . . 0.0 109.873 177.127 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.675 ' HA ' ' HB3' ' A' ' 23' ' ' LYS . 5.7 tp-100 . . . . . 0 N--CA 1.478 0.973 0 CA-C-O 120.457 0.17 . . . . 0.0 110.6 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.49 ' OE2' ' HG2' ' A' ' 23' ' ' LYS . 2.0 mp0 -52.46 96.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.613 168.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -109.14 66.98 0.64 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.49 -108.91 1.48 Allowed Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.199 -0.761 . . . . 0.0 111.199 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -121.54 62.27 0.52 Allowed Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.161 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.443 ' NH1' ' HG3' ' A' ' 2' ' ' GLU . 18.2 tpp180 56.12 78.71 0.37 Allowed Pre-proline 0 CA--C 1.534 0.353 0 CA-C-O 121.311 0.576 . . . . 0.0 111.458 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.91 58.28 4.42 Favored 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.111 2.541 . . . . 0.0 110.621 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.893 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -77.82 -34.72 37.76 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.283 -175.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -169.12 -92.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.931 0.396 . . . . 0.0 111.165 -178.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -155.19 -47.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.259 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.2 p -76.12 -107.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.517 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 5.1 tp10 -153.84 -72.97 0.13 Allowed 'General case' 0 C--O 1.219 -0.5 0 O-C-N 122.105 -0.372 . . . . 0.0 111.457 -175.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.64 HG12 HD13 ' A' ' 55' ' ' LEU . 77.7 t -57.75 -55.27 22.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -174.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.559 ' HA ' ' CD1' ' A' ' 55' ' ' LEU . 35.4 t -59.53 -35.44 74.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.479 0.657 . . . . 0.0 110.441 178.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.57 ' HG3' ' H ' ' A' ' 8' ' ' GLY . 6.3 ttmt -67.7 -46.52 72.01 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.755 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.593 ' HB3' HH21 ' A' ' 20' ' ' ARG . 26.0 mm-40 -57.41 -53.79 54.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.961 178.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -56.98 -55.37 35.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.246 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.57 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 69.8 mt -61.44 -55.35 32.29 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-O 120.533 0.206 . . . . 0.0 111.46 -174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.893 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 26.3 t-20 -66.47 -45.53 79.41 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -171.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 16' ' ' GLU . 18.6 ttp85 -67.3 -39.04 85.92 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.438 177.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -61.33 -46.15 91.47 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 122.308 1.052 . . . . 0.0 109.192 174.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.746 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 1.2 t80 -55.76 -38.08 69.38 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 112.864 -1.971 . . . . 0.0 111.974 -175.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.675 ' HB3' ' HA ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -85.46 -28.98 24.67 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.25 -0.58 . . . . 0.0 111.476 178.023 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.591 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 69.0 m -59.9 -40.26 88.19 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.886 -178.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.7 mp -69.66 -25.02 63.7 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.375 179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 43.0 mm -78.76 -51.61 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.97 -46.4 89.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.177 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.484 ' HB2' HG12 ' A' ' 30' ' ' VAL . 53.2 mtp85 -72.92 -13.64 61.3 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.009 -177.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.75 45.08 54.65 Favored Glycine 0 C--N 1.332 0.344 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.713 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 6.0 p -138.26 51.21 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.905 0 CA-C-O 122.378 1.085 . . . . 0.0 109.883 -170.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -130.82 179.96 5.66 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.593 -0.692 . . . . 0.0 111.345 -172.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.586 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 71.0 m-85 72.28 -48.14 0.68 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.978 0.911 . . . . 0.0 112.131 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.484 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 15.0 m -64.43 104.85 0.83 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 177.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -55.44 -41.34 72.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.854 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -63.32 -34.15 77.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.597 0.713 . . . . 0.0 110.197 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 85.9 m -79.71 -43.94 21.73 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.259 -178.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 33' ' ' SER . 67.5 mt -59.34 -31.74 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.494 ' HG3' HD21 ' A' ' 70' ' ' LEU . 35.2 tt0 -61.37 -55.13 34.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.997 -1.002 . . . . 0.0 110.812 175.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HA ' HD12 ' A' ' 42' ' ' ILE . 21.9 tptm -67.13 -35.28 79.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.212 -178.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -70.06 -34.59 73.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.196 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 41' ' ' LEU . 11.5 mt -61.01 -41.65 96.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 172.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.476 HD12 ' HA ' ' A' ' 39' ' ' LYS . 99.0 mt -59.57 -48.67 86.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.735 175.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 t -63.76 -48.71 75.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.891 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.547 ' HZ ' ' HG2' ' A' ' 20' ' ' ARG . 11.3 t80 -63.95 -34.57 78.28 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.28 -176.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.477 ' SG ' HG23 ' A' ' 62' ' ' THR . 0.5 OUTLIER -60.44 -33.25 72.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.632 176.868 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -86.87 -39.39 15.86 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.44 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -75.18 -15.66 60.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.931 -173.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.766 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -72.97 -171.17 0.83 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.865 0.364 . . . . 0.0 111.466 178.849 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -93.24 164.34 13.27 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.424 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -47.61 -41.47 18.73 Favored Glycine 0 C--N 1.331 0.253 0 O-C-N 123.661 0.601 . . . . 0.0 114.1 -171.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -61.05 -43.22 99.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.222 0.534 . . . . 0.0 110.569 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 21.0 mt-10 -79.04 -30.42 44.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.171 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -63.57 -18.89 64.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 175.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 40.6 mmt180 -86.61 -46.27 10.25 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.858 172.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.64 HD13 HG12 ' A' ' 13' ' ' VAL . 0.0 OUTLIER -62.46 -25.13 67.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.775 -174.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.632 ' N ' HD23 ' A' ' 55' ' ' LEU . 25.7 p -72.66 -14.75 61.65 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.255 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.501 ' HA ' ' OG1' ' A' ' 62' ' ' THR . 66.9 m-85 -72.72 -33.72 66.63 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.173 0.511 . . . . 0.0 109.626 171.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.417 ' HD2' ' HA ' ' A' ' 55' ' ' LEU . 60.0 m-85 -85.58 -29.24 24.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.54 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.569 HD13 ' HG ' ' A' ' 55' ' ' LEU . 8.1 mp -80.23 -6.04 57.18 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.852 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.55 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 84.43 -0.8 89.24 Favored Glycine 0 C--O 1.228 -0.275 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.233 176.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' ' 70' ' ' LEU . . . -80.07 42.54 0.57 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.148 0.499 . . . . 0.0 111.465 -177.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.501 ' OG1' ' HA ' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -145.17 133.3 21.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.899 -179.232 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -73.25 -7.7 52.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.74 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -90.5 -18.51 25.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.262 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.71 -160.75 0.81 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.377 -175.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.67 132.56 35.3 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.105 -178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 p -85.32 -18.09 34.88 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -175.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -77.96 -24.07 48.28 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.655 -0.418 . . . . 0.0 111.439 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.55 HG23 ' HA3' ' A' ' 60' ' ' GLY . 17.3 tt -85.09 -23.84 7.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.309 0.576 . . . . 0.0 109.653 173.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.494 HD21 ' HG3' ' A' ' 38' ' ' GLU . 41.1 tp -63.06 -42.7 99.75 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.094 175.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 p -69.17 -15.42 63.4 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.877 177.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.547 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 53.8 mm-40 -77.82 -56.67 4.31 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.672 177.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 41.7 t -66.45 -34.02 67.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 0 CA-C-O 120.973 0.416 . . . . 0.0 111.748 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.417 HG22 HG22 ' A' ' 37' ' ' ILE . 7.6 p -57.33 -27.52 62.29 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.415 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.4 OUTLIER -74.17 -54.49 3.36 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -177.861 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.547 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 23.9 Cg_endo -64.74 -17.73 60.4 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.653 1.569 . . . . 0.0 113.195 177.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 24.5 mmt -75.69 -16.53 60.16 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.473 173.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.586 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 34.1 t -86.19 -52.77 5.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.861 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.562 HG13 ' HG3' ' A' ' 81' ' ' MET . 7.3 p -109.06 142.34 21.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.011 -176.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.746 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 72.5 m80 -57.15 111.37 1.04 Allowed 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.844 0.354 . . . . 0.0 110.593 -177.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.562 ' HG3' HG13 ' A' ' 79' ' ' VAL . 32.1 mtp -140.8 170.08 10.24 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -168.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.437 ' C ' HG13 ' A' ' 86' ' ' ILE . 30.1 Cg_exo -41.0 0.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.354 0.828 1 C-N-CA 127.623 5.549 . . . . 0.0 118.093 171.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.469 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -38.17 -38.61 0.35 Allowed 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 120.195 1.361 . . . . 0.0 114.522 -169.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.604 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.4 OUTLIER -60.64 -38.17 83.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.891 -0.506 . . . . 0.0 110.766 177.903 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.499 ' N ' ' HG2' ' A' ' 84' ' ' MET . 51.6 mttm -86.25 -22.97 26.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.221 176.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.469 ' HB ' ' HA ' ' A' ' 83' ' ' ALA . 25.8 mt -62.17 -33.1 56.93 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.161 -178.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.567 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 41.8 t -63.86 -36.1 82.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.167 0.508 . . . . 0.0 110.604 174.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 45.7 mt-10 -66.81 -39.14 87.6 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.703 176.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.8 mttm -62.38 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.678 175.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 93' ' ' LEU . 14.6 mt -60.28 -31.59 70.38 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.595 177.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 9.5 mtpm? -65.2 -19.31 65.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.25 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -23.93 50.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 109.789 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.7 mp -84.39 -52.84 5.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.745 175.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -144.16 132.48 21.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.982 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.0 p -85.1 -18.45 34.22 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -174.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.704 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 78.7 mt-30 -67.61 -33.18 74.48 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.569 0.223 . . . . 0.0 110.644 -178.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 63.5 mt -46.31 -48.96 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.14 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.87 -34.93 15.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.685 -177.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.671 ' HA ' ' HE3' ' A' ' 101' ' ' LYS . 16.3 mm-40 -89.55 21.15 3.55 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -171.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.752 ' HB3' ' HG3' ' A' ' 51' ' ' LYS . 34.0 mt -67.72 -54.22 21.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.443 173.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.671 ' HE3' ' HA ' ' A' ' 99' ' ' GLU . 30.0 mmtp 70.18 139.71 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.753 0.787 . . . . 0.0 112.47 176.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.93 83.13 2.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.873 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 59.28 99.93 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 O-C-N 123.934 0.771 . . . . 0.0 111.419 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -79.3 36.42 0.3 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.666 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.248 1.021 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.438 -179.975 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 61.47 72.52 0.51 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 121.591 0.71 . . . . 0.0 109.626 -178.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.27 113.32 17.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.701 -173.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 66.15 32.38 82.12 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.37 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.548 ' O ' ' HD2' ' A' ' 6' ' ' ARG . . . 87.2 -131.13 10.4 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.24 -176.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.579 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 14.9 mmm180 -124.7 59.05 19.42 Favored Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 117.001 0.4 . . . . 0.0 111.47 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.54 ' HD3' ' C ' ' A' ' 5' ' ' GLY . 93.9 Cg_endo -103.14 47.93 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 123.259 2.639 . . . . 0.0 111.654 -179.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.646 ' HA3' ' O ' ' A' ' 15' ' ' LYS . . . -77.46 -27.43 59.4 Favored Glycine 0 CA--C 1.507 -0.433 0 C-N-CA 119.316 -1.421 . . . . 0.0 112.088 -171.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 1.017 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -171.29 -97.77 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.756 0.312 . . . . 0.0 110.881 177.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -161.75 176.91 10.41 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 82.9 m 60.62 -85.57 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 123.213 0.605 . . . . 0.0 111.129 -175.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.796 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 37.0 tt0 -179.61 -76.29 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 178.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.925 HG12 HD22 ' A' ' 55' ' ' LEU . 90.6 t -60.4 -39.58 81.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -167.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 98' ' ' CYS . 5.7 p -70.98 -32.21 68.98 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.049 178.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.796 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 14.8 ptmt -73.81 -31.14 63.11 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 -177.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -63.33 -51.81 64.46 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.147 174.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.403 ' CE2' ' HD2' ' A' ' 44' ' ' PHE . 44.0 t80 -60.53 -53.19 60.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.041 -179.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.607 HD12 ' HB2' ' A' ' 9' ' ' ALA . 84.7 mt -58.82 -47.61 84.21 Favored 'General case' 0 C--O 1.22 -0.453 0 O-C-N 123.126 0.266 . . . . 0.0 111.549 -174.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.514 ' HB2' ' CA ' ' A' ' 8' ' ' GLY . 29.0 t-20 -60.2 -49.46 77.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.716 0.293 . . . . 0.0 111.181 -178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 63.6 mtp180 -61.12 -46.06 92.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.275 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -65.83 -47.65 74.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.172 0.511 . . . . 0.0 110.601 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.479 ' O ' HG12 ' A' ' 26' ' ' ILE . 64.1 t80 -51.33 -50.27 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.713 -178.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.531 ' NZ ' ' HB2' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -78.52 -33.11 48.2 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.543 -176.583 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.505 ' N ' ' HD3' ' A' ' 23' ' ' LYS . 8.4 t -62.68 -36.02 81.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 0.0 110.786 -176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.824 ' HG ' HG22 ' A' ' 30' ' ' VAL . 2.8 mp -72.91 -27.53 61.93 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.929 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 22' ' ' TYR . 49.7 mm -76.2 -32.97 23.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.51 -57.13 10.06 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.529 0.68 . . . . 0.0 110.502 174.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.7 mtm-85 -75.23 -21.43 58.63 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.486 -175.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.97 45.91 90.9 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.422 178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.824 HG22 ' HG ' ' A' ' 25' ' ' LEU . 2.8 m -96.93 4.08 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.541 0.686 . . . . 0.0 111.461 -173.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.465 HD21 HD23 ' A' ' 25' ' ' LEU . 20.9 m120 -82.56 -171.32 3.42 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-N 115.415 -0.812 . . . . 0.0 111.972 -170.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 92.7 m-85 71.76 -34.9 0.31 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.502 0.721 . . . . 0.0 111.252 -176.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.506 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 16.6 m -88.09 103.02 15.35 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.6 mm? -59.09 -38.99 80.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.243 -176.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.4 -38.07 85.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.067 0.461 . . . . 0.0 110.674 178.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.506 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 23.0 m -73.7 -46.14 47.99 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.757 -178.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.436 HG22 HG22 ' A' ' 74' ' ' THR . 48.1 mt -59.97 -31.63 48.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.476 0.655 . . . . 0.0 109.281 177.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -70.09 -43.67 70.63 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.652 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HD3' ' C ' ' A' ' 39' ' ' LYS . 12.7 tmtt? -66.92 -42.06 86.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.076 178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HG3' HG21 ' A' ' 30' ' ' VAL . 55.3 mm-40 -67.72 -33.51 75.03 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.486 -179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.611 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 13.1 mt -54.0 -51.75 62.95 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 170.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 90.6 mt -58.69 -49.78 81.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 48.9 m -58.83 -48.76 80.21 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.504 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.403 ' HD2' ' CE2' ' A' ' 17' ' ' PHE . 14.7 t80 -67.33 -31.37 71.6 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.881 0.372 . . . . 0.0 110.187 -175.209 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 62.8 m -64.68 -37.91 89.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.64 177.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.428 ' O ' HD13 ' A' ' 46' ' ' LEU . 2.0 tm? -86.06 -36.46 19.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.131 0.491 . . . . 0.0 110.512 -179.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.33 -22.16 66.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.0 -175.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.764 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -76.76 -169.44 1.27 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.635 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -97.82 175.74 6.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.645 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.91 -40.94 35.74 Favored Glycine 0 CA--C 1.518 0.276 0 O-C-N 123.621 0.576 . . . . 0.0 114.463 -170.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.462 ' HE2' ' HA ' ' A' ' 102' ' ' TYR . 0.2 OUTLIER -62.2 -50.85 70.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.07 0.435 . . . . 0.0 110.484 -179.648 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.764 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 1.6 mp0 -71.75 -34.23 69.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.621 -178.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -57.44 -45.6 84.5 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -71.61 -37.61 70.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.39 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.925 HD22 HG12 ' A' ' 13' ' ' VAL . 22.9 tp -53.75 -32.59 52.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.555 178.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 32.6 t -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -176.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -73.49 -29.76 62.7 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.572 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.458 ' HB3' HG13 ' A' ' 97' ' ' ILE . 87.7 m-85 -74.68 -44.59 49.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.406 174.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.697 HD23 HD11 ' A' ' 97' ' ' ILE . 77.6 mt -67.28 -27.77 67.47 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.012 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.433 ' HA3' HG21 ' A' ' 69' ' ' ILE . . . 91.56 -9.65 76.61 Favored Glycine 0 C--O 1.225 -0.462 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.756 172.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.648 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . -67.14 -16.16 64.15 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 117.159 0.48 . . . . 0.0 112.264 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 24.1 m -72.04 138.72 48.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -74.52 47.34 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.24 0.543 . . . . 0.0 111.552 -176.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -132.4 -32.3 1.35 Allowed 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.516 178.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.12 -161.23 0.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.622 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.492 ' O ' HG22 ' A' ' 69' ' ' ILE . . . -63.32 140.17 58.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 174.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' HD13 ' A' ' 70' ' ' LEU . 33.3 p -85.74 -24.49 26.88 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -69.13 -30.05 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.39 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.492 HG22 ' O ' ' A' ' 66' ' ' ALA . 19.5 tt -66.71 -22.6 29.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.779 0.323 . . . . 0.0 110.654 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' A' ' 67' ' ' THR . 10.3 mp -61.02 -53.26 59.45 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.64 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 4.4 p -65.92 -34.02 77.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.544 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -58.65 -31.15 67.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.646 177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 62.7 t -86.28 -46.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.991 0.424 . . . . 0.0 110.649 175.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.64 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 46.5 p -59.47 -36.04 75.25 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -175.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 71' ' ' SER . 1.5 mpp_? -58.93 -55.81 42.52 Favored Pre-proline 0 CA--C 1.532 0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.214 -178.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -65.61 -39.75 20.11 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 121.266 1.311 . . . . 0.0 112.421 175.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.1 mmt -60.27 -19.5 55.08 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.3 t -62.3 -14.97 44.74 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.553 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -151.47 175.75 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -176.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.553 ' H ' HG22 ' A' ' 79' ' ' VAL . 12.8 m-70 -64.43 122.44 16.75 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 176.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 43.0 mmm -140.71 167.9 16.18 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -170.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 81' ' ' MET . 76.3 Cg_exo -46.46 0.4 0.02 OUTLIER 'Trans proline' 0 C--O 1.208 -1.016 1 C-N-CA 126.966 5.11 . . . . 0.0 117.3 176.09 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.574 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -35.9 -40.18 0.18 Allowed 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 -156.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 1.017 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.21 -36.17 68.13 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.672 0.669 . . . . 0.0 110.826 174.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 19.1 mtpp -85.12 -20.43 30.33 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.369 176.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 32.7 mt -64.42 -41.29 91.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.516 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.695 ' HB3' ' HB1' ' A' ' 9' ' ' ALA . 51.6 t -66.42 -22.2 66.22 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.743 177.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.461 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 48.2 mt-10 -75.74 -37.98 58.88 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.592 175.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.6 mttt -66.59 -30.82 71.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.031 174.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 87' ' ' CYS . 93.4 mt -70.09 -14.97 62.91 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.247 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 30.7 mtpp -67.81 -17.55 64.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.701 0.286 . . . . 0.0 110.645 178.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.757 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -69.51 -28.14 65.78 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.222 0.534 . . . . 0.0 109.896 174.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.41 ' N ' HD12 ' A' ' 93' ' ' LEU . 6.0 mp -88.58 -48.7 7.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.581 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 8.8 t70 -146.44 126.23 13.5 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.9 m -78.21 -26.21 47.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.68 0.276 . . . . 0.0 111.517 -174.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.4 -12.57 51.75 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.598 -175.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.697 HD11 HD23 ' A' ' 59' ' ' LEU . 17.7 tt -48.35 -34.05 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.595 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . 30.5 p -82.36 -28.45 31.54 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.102 -176.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -79.18 -99.4 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.422 -171.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 8.5 mp 64.48 -62.07 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.365 0.666 . . . . 0.0 111.475 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 69.8 mmtt 69.47 129.0 0.03 OUTLIER 'General case' 0 C--O 1.233 0.227 0 C-N-CA 123.39 0.676 . . . . 0.0 111.141 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.462 ' HA ' ' HE2' ' A' ' 51' ' ' LYS . 80.4 m-85 -69.1 -167.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.049 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -67.53 -19.72 65.33 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.234 -0.291 . . . . 0.0 111.0 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.4 tppp? 73.15 0.41 3.67 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 123.809 0.693 . . . . 0.0 109.975 178.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 44.8 m . . . . . 0 C--O 1.247 0.956 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.884 -166.817 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.45 ' HA ' ' HB3' ' A' ' 23' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.556 ' HA ' ' OD1' ' A' ' 19' ' ' ASN . 44.2 mt-10 60.09 -169.68 0.15 Allowed 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.349 0.406 . . . . 0.0 111.412 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.441 ' HB3' ' CG ' ' A' ' 7' ' ' PRO . . . 178.74 87.58 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.688 178.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 77.27 -83.8 1.08 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.588 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -127.81 36.85 2.44 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.852 -0.69 . . . . 0.0 112.167 -179.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.425 ' O ' ' HE2' ' A' ' 15' ' ' LYS . 75.0 mtt180 54.23 83.44 0.23 Allowed Pre-proline 0 N--CA 1.466 0.345 0 CA-C-O 121.264 0.554 . . . . 0.0 111.305 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.441 ' CG ' ' HB3' ' A' ' 3' ' ' ALA . 2.5 Cg_endo -83.87 56.81 5.28 Favored 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.39 2.727 . . . . 0.0 111.102 -173.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.632 ' HA3' ' HA ' ' A' ' 15' ' ' LYS . . . -71.92 -23.96 77.26 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.587 -0.816 . . . . 0.0 111.801 -178.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.601 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . -167.34 -93.95 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 CA-C-O 120.714 0.292 . . . . 0.0 111.565 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -164.16 -32.89 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.793 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.5 p -75.84 -90.09 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.232 -179.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 43.3 tt0 -170.81 -76.73 0.02 OUTLIER 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.767 HG12 HD22 ' A' ' 55' ' ' LEU . 26.4 t -60.32 -46.13 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.124 0.488 . . . . 0.0 111.11 -173.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.62 ' HA ' HD21 ' A' ' 55' ' ' LEU . 45.6 t -63.98 -28.89 70.12 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.374 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.632 ' HA ' ' HA3' ' A' ' 8' ' ' GLY . 55.1 mtpt -65.1 -50.46 66.0 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.596 0.712 . . . . 0.0 109.608 174.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 12' ' ' GLU . 11.5 mm-40 -54.51 -55.15 32.08 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.371 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.452 ' HB2' HD23 ' A' ' 55' ' ' LEU . 24.4 t80 -58.28 -55.67 31.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.637 -176.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.489 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 92.4 mt -61.98 -48.05 82.1 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -173.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.556 ' OD1' ' HA ' ' A' ' 2' ' ' GLU . 4.3 t-20 -69.6 -42.85 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.258 0.551 . . . . 0.0 110.686 -176.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -70.74 -36.84 73.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.203 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -59.36 -45.86 90.25 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.544 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -52.68 -56.79 12.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.451 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER -69.69 -25.12 63.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.791 -175.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.574 ' O ' ' HG2' ' A' ' 28' ' ' ARG . 74.4 m -67.76 -56.02 10.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.864 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.646 HD12 HG22 ' A' ' 30' ' ' VAL . 3.9 mm? -61.01 -39.02 88.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.275 -177.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.544 HG12 ' O ' ' A' ' 22' ' ' TYR . 47.4 mm -65.83 -37.29 79.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.867 0.365 . . . . 0.0 110.81 177.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.84 -45.0 65.28 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.208 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.777 ' HG3' HG13 ' A' ' 30' ' ' VAL . 2.8 ptm180 -74.69 -13.6 60.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.905 0.383 . . . . 0.0 111.34 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.52 32.89 14.68 Favored Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 121.048 -0.596 . . . . 0.0 112.403 170.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.777 HG13 ' HG3' ' A' ' 28' ' ' ARG . 0.2 OUTLIER -142.37 112.54 2.71 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -178.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.838 ' HA ' HD11 ' A' ' 37' ' ' ILE . 0.2 OUTLIER -169.12 15.57 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -179.282 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -125.06 13.68 8.41 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 -174.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.633 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 49.4 m -122.32 124.47 43.8 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.6 mm? -68.91 -38.62 79.69 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -172.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.45 -15.64 60.41 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.414 0.626 . . . . 0.0 109.79 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.633 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 37.8 m -84.06 -48.2 10.15 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.943 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.838 HD11 ' HA ' ' A' ' 31' ' ' ASN . 33.7 mm -59.44 -29.74 42.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -59.51 -43.31 93.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.782 175.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HB ' ' A' ' 42' ' ' ILE . 14.5 mmmm -83.71 -34.62 24.86 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.121 -178.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HB3' HD11 ' A' ' 25' ' ' LEU . 11.2 mm-40 -66.39 -33.88 76.71 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.3 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.76 -34.09 72.52 Favored 'General case' 0 CA--C 1.522 -0.134 0 CA-C-O 121.114 0.483 . . . . 0.0 109.845 171.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.643 HG12 ' HA ' ' A' ' 62' ' ' THR . 80.9 mt -73.11 -51.6 25.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.232 178.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 37.9 t -58.78 -46.74 86.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.755 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -65.57 -35.57 81.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.017 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 25.9 t -65.07 -33.34 75.8 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.87 177.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 40.6 tp -87.07 -15.93 37.09 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.187 0.518 . . . . 0.0 111.05 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -90.48 -14.96 31.71 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.937 -175.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.78 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.9 OUTLIER -92.37 -169.91 2.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.548 -173.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -94.82 173.62 7.51 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.875 177.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -49.44 -49.17 33.13 Favored Glycine 0 C--N 1.33 0.242 0 O-C-N 123.821 0.701 . . . . 0.0 114.651 -168.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.783 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 12.6 mptt -61.98 -41.29 97.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.216 0.508 . . . . 0.0 111.127 -179.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.78 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 13.8 mm-40 -68.58 -40.47 80.5 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.195 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -59.28 -36.52 75.7 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.48 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -77.62 -37.85 49.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.647 177.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.767 HD22 HG12 ' A' ' 13' ' ' VAL . 53.3 tp -63.48 -29.5 70.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.154 -174.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 13.4 p -63.59 -27.33 69.17 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.771 -179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -64.71 -30.65 71.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 0.0 110.186 175.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.505 ' CD1' HG12 ' A' ' 97' ' ' ILE . 85.1 m-85 -86.48 -22.59 26.35 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.683 -179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' O ' HG21 ' A' ' 73' ' ' VAL . 87.3 mt -106.19 29.63 6.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.861 0.362 . . . . 0.0 111.772 -175.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.582 ' O ' ' HG ' ' A' ' 70' ' ' LEU . . . 63.15 62.97 4.92 Favored Glycine 0 N--CA 1.451 -0.344 0 CA-C-N 115.732 -0.667 . . . . 0.0 113.504 173.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -135.6 177.62 7.68 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.643 ' HA ' HG12 ' A' ' 42' ' ' ILE . 42.9 p 62.9 148.12 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.492 1.117 . . . . 0.0 112.31 -179.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -84.68 56.43 3.86 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.624 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -163.19 -35.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.165 -175.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.78 -170.42 2.98 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -175.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -48.29 101.85 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.882 0.739 . . . . 0.0 111.056 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -86.1 -15.42 41.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.262 -169.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.1 tmtp? -79.35 -46.38 17.76 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 17.8 pt -69.8 -14.27 18.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.613 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 60' ' ' GLY . 3.2 tt -55.64 -42.8 75.51 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.766 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.608 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 10.8 p -74.23 -28.16 61.12 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.85 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -70.92 -22.75 62.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.059 0.457 . . . . 0.0 110.443 -177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 59' ' ' LEU . 61.7 t -88.07 -55.31 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.044 172.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.479 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 10.6 p -56.06 -43.45 77.92 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -172.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.629 ' HA ' HD11 ' A' ' 34' ' ' LEU . 11.5 mpt_? -62.36 -53.02 61.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.35 -177.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' A' ' 75' ' ' ARG . 53.2 Cg_exo -57.94 -38.81 90.79 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 121.742 1.628 . . . . 0.0 112.803 172.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.5 mmt -58.75 -25.12 62.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.637 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.2 t -63.12 -14.03 43.63 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -177.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.574 HG22 ' H ' ' A' ' 80' ' ' HIS . 9.7 p -149.79 175.01 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.574 ' H ' HG22 ' A' ' 79' ' ' VAL . 28.1 m80 -72.62 109.04 5.98 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.783 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 23.7 mmm -125.56 166.9 18.37 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 121.936 0.874 . . . . 0.0 113.179 -170.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.783 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 29.1 Cg_exo -39.89 2.95 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.951 1 C-N-CA 128.211 5.94 . . . . 0.0 118.339 169.525 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.555 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -39.17 -32.78 0.11 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -164.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.601 ' O ' ' HA ' ' A' ' 9' ' ' ALA . 0.3 OUTLIER -61.87 -35.32 77.95 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.388 0.995 . . . . 0.0 110.397 176.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' A' ' 88' ' ' GLU . 16.1 ptpt -86.43 -19.59 29.41 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 176.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 1.014 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 37.7 mt -61.63 -41.72 91.4 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.327 -179.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.524 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 49.1 t -70.36 -22.32 62.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.322 0.582 . . . . 0.0 110.641 176.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.54 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 17.4 mm-40 -70.13 -26.25 63.86 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 174.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 1.014 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 8.5 mtmp? -81.53 -28.99 33.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.494 175.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.567 ' HA ' HD13 ' A' ' 93' ' ' LEU . 2.8 mm? -63.57 -29.2 70.49 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.474 173.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 88' ' ' GLU . 45.2 mttp -55.24 -26.76 41.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.06 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.418 ' HD2' ' N ' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -75.5 -15.55 60.39 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.007 0.432 . . . . 0.0 110.515 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.567 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.5 mp -91.2 -52.98 4.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.452 176.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.563 ' HB3' HG13 ' A' ' 97' ' ' ILE . 25.6 t70 -158.65 138.7 12.19 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.834 -178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 43.0 m -85.22 -24.63 27.75 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.191 -176.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.436 ' HB3' ' OD2' ' A' ' 94' ' ' ASP . 8.1 tt0 -70.37 -22.23 62.79 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.299 -178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.563 HG13 ' HB3' ' A' ' 94' ' ' ASP . 36.3 mt -52.69 -45.75 49.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.717 0.77 . . . . 0.0 109.733 172.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -87.0 -47.27 9.09 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.972 -178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -88.22 42.73 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.632 -177.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.476 HD23 HG11 ' A' ' 13' ' ' VAL . 18.4 tp -70.35 -53.91 14.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.836 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.487 ' HB3' ' HA ' ' A' ' 104' ' ' LYS . 72.6 mmtt 69.4 121.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.602 0.715 . . . . 0.0 112.003 176.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.783 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 95.4 m-85 -67.07 -68.26 0.39 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.023 178.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -116.63 22.03 13.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.036 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 101' ' ' LYS . 61.8 mmtt 66.7 6.94 4.82 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.105 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 8.8 m . . . . . 0 N--CA 1.439 -1.009 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.95 -166.006 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.486 ' NE2' ' HA ' ' A' ' 24' ' ' SER . 20.2 mt-30 . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.976 0.417 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.502 ' HG2' ' CZ ' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -90.63 -175.15 4.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.293 172.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.452 ' HB3' HD21 ' A' ' 19' ' ' ASN . . . -129.54 56.32 1.72 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.811 0.339 . . . . 0.0 111.257 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.7 -99.9 1.91 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.432 172.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -81.75 12.14 43.11 Favored Glycine 0 N--CA 1.455 -0.094 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.789 -177.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.603 ' HB3' ' HG3' ' A' ' 15' ' ' LYS . 12.2 mpt_? 55.62 72.84 0.95 Allowed Pre-proline 0 C--N 1.331 -0.229 0 C-N-CA 122.873 0.469 . . . . 0.0 112.231 178.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.449 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . 13.9 Cg_exo -70.16 52.62 1.14 Allowed 'Trans proline' 0 CA--C 1.53 0.313 0 C-N-CA 122.562 2.175 . . . . 0.0 111.622 172.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -98.62 -30.14 7.01 Favored Glycine 0 N--CA 1.442 -0.921 0 N-CA-C 111.452 -0.659 . . . . 0.0 111.452 -179.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.577 ' O ' ' HE3' ' A' ' 15' ' ' LYS . . . 164.38 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.162 0 C-N-CA 123.907 0.883 . . . . 0.0 109.855 -178.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -110.86 -19.05 12.95 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 176.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.95 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 62.3 m -71.28 -0.99 11.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.902 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.858 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 36.5 tt0 72.85 -65.84 0.34 Allowed 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 114.892 -1.049 . . . . 0.0 113.626 166.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.905 HG12 HD22 ' A' ' 55' ' ' LEU . 57.6 t -62.61 -42.67 96.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 119.958 -0.697 . . . . 0.0 110.031 -176.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.682 ' SG ' ' HB2' ' A' ' 11' ' ' CYS . 29.9 p -74.74 -18.56 60.48 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.384 175.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.858 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 9.6 ptmt -72.1 -38.16 69.4 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -178.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -67.74 -51.82 44.79 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.561 175.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -58.09 -54.94 41.24 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.552 -178.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.9 mt -65.83 -32.75 74.45 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 121.33 -0.148 . . . . 0.0 111.208 -175.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 6' ' ' ARG . 3.0 t-20 -71.58 -53.95 12.05 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.069 -0.253 . . . . 0.0 110.909 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 68.9 mtp180 -53.16 -51.0 63.42 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.047 176.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.77 -50.61 72.66 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.789 -179.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.653 ' O ' HG12 ' A' ' 26' ' ' ILE . 26.3 t80 -54.45 -55.63 26.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.974 -1.012 . . . . 0.0 110.867 -178.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 23' ' ' LYS . 20.2 mmtt -69.9 -38.28 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -175.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.486 ' HA ' ' NE2' ' A' ' 1' ' ' GLN . 46.7 t -64.31 -27.87 69.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 0.0 110.46 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.82 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 1.4 tp -82.08 -36.31 27.76 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.31 -176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.653 HG12 ' O ' ' A' ' 22' ' ' TYR . 44.6 mm -65.41 -49.1 80.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.141 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.473 ' HB3' HE22 ' A' ' 1' ' ' GLN . 24.8 t70 -66.0 -42.05 90.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.673 -176.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.539 ' HB2' HG12 ' A' ' 30' ' ' VAL . 81.5 mtm180 -77.34 -12.52 59.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.813 0.34 . . . . 0.0 111.729 -177.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.48 39.61 56.21 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.579 HG13 ' HA ' ' A' ' 25' ' ' LEU . 2.2 p -126.09 27.73 2.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-O 122.921 1.343 . . . . 0.0 109.444 -170.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.82 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 3.6 t-20 -131.92 99.84 4.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.335 -0.848 . . . . 0.0 112.216 -174.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.555 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 3.7 t80 166.13 -28.75 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 O-C-N 124.627 1.205 . . . . 0.0 108.507 174.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.3 m -82.57 120.85 26.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.219 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.8 mm? -59.29 -38.58 80.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.498 -0.773 . . . . 0.0 112.619 -175.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.52 -25.67 50.44 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.005 0.431 . . . . 0.0 110.618 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.447 HG21 HG23 ' A' ' 30' ' ' VAL . 29.7 m -77.69 -44.72 27.07 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.895 -179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.468 HD11 ' HA ' ' A' ' 78' ' ' SER . 66.0 mt -61.2 -29.78 46.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.228 0.537 . . . . 0.0 109.688 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -63.1 -54.2 41.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.06 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.2 -41.8 99.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.27 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 54.8 mm-40 -69.77 -37.56 76.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.816 -176.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.582 ' HB3' ' HB1' ' A' ' 61' ' ' ALA . 25.4 mt -57.12 -43.9 82.8 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 172.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 89.2 mt -61.69 -48.48 88.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.453 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 51.1 m -69.81 -41.67 74.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.772 0.32 . . . . 0.0 111.845 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.509 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 19.2 t80 -67.47 -34.15 76.58 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.08 0.467 . . . . 0.0 110.349 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 21.2 m -60.97 -29.88 69.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.664 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 tp -88.3 -26.34 22.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.022 0.439 . . . . 0.0 111.273 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -82.22 -19.09 40.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.423 -174.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.799 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.8 OUTLIER -74.61 -173.34 1.77 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.871 -178.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.8 173.34 7.51 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.909 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -51.82 -44.33 55.23 Favored Glycine 0 CA--C 1.518 0.273 0 O-C-N 123.502 0.501 . . . . 0.0 114.24 -170.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -59.78 -38.58 82.26 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 117.208 0.504 . . . . 0.0 110.667 178.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.799 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 26.5 mt-10 -83.28 -37.51 23.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.936 -175.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -58.04 -45.86 86.29 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' ' CD2' ' A' ' 57' ' ' TYR . 40.9 tpt85 -76.43 -30.72 57.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.383 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.905 HD22 HG12 ' A' ' 13' ' ' VAL . 14.9 tp -58.5 -31.0 67.46 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.002 176.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.667 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 33.9 t -57.36 -30.12 64.59 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.644 -177.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.422 ' CD2' ' HD2' ' A' ' 54' ' ' ARG . 90.3 m-85 -65.73 -16.72 64.04 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.971 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.422 ' HB3' HG12 ' A' ' 97' ' ' ILE . 87.5 m-85 -86.28 -48.81 8.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.006 0.432 . . . . 0.0 110.583 175.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 78.6 mt -75.26 -17.35 60.33 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.055 -176.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.516 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 98.92 -108.58 3.61 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -176.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.667 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . . . 50.57 21.82 0.95 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 172.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 13.5 p -140.48 150.99 44.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.139 -178.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -90.54 47.25 1.41 Allowed 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -151.41 -52.82 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.921 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.59 104.0 14.85 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.867 -175.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.725 ' O ' HG22 ' A' ' 69' ' ' ILE . . . 49.42 61.19 3.27 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.895 0.747 . . . . 0.0 110.719 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 70' ' ' LEU . 1.0 OUTLIER -61.04 -18.28 56.93 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -167.637 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 23.3 ttpp -66.49 -27.83 68.09 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.052 -0.405 . . . . 0.0 110.915 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.725 HG22 ' O ' ' A' ' 66' ' ' ALA . 20.4 tt -68.77 -21.82 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 121.02 0.438 . . . . 0.0 110.213 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.424 ' HG ' ' HA ' ' A' ' 61' ' ' ALA . 0.6 OUTLIER -61.28 -46.12 91.66 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 174.724 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.1 m -69.0 -30.64 69.08 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.489 178.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.531 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 65.4 mm-40 -66.62 -58.08 5.9 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.372 179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.608 ' O ' ' HB2' ' A' ' 77' ' ' MET . 61.4 t -60.76 -44.77 98.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.401 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.9 p -52.92 -35.33 58.23 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -176.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HD3' ' O ' ' A' ' 71' ' ' SER . 7.1 mpt_? -63.95 -56.08 27.6 Favored Pre-proline 0 CA--C 1.532 0.27 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.487 -173.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.531 ' HD2' ' O ' ' A' ' 72' ' ' GLU . 37.8 Cg_endo -70.63 -26.78 23.12 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 121.212 1.275 . . . . 0.0 112.044 173.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 73' ' ' VAL . 1.6 tpt -67.0 -19.81 65.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.999 0.428 . . . . 0.0 110.677 -179.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.468 ' HA ' HD11 ' A' ' 37' ' ' ILE . 67.6 m -73.04 -12.85 61.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.704 -179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.428 HG13 ' HG2' ' A' ' 81' ' ' MET . 2.8 p -130.92 148.87 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.5 m170 -55.42 109.7 0.59 Allowed 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.778 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 26.9 mmm -132.6 164.05 46.39 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -165.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.778 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 32.9 Cg_exo -40.37 3.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.539 0.768 1 C-N-CA 128.415 6.076 . . . . 0.0 118.333 169.36 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.541 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -36.97 -32.83 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.982 2.215 . . . . 0.0 116.982 -159.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.725 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -60.32 -39.49 87.22 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.933 1.242 . . . . 0.0 110.35 173.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.459 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 38.2 ttpt -80.56 -14.5 58.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.089 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.541 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 47.5 mt -72.02 -42.79 68.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 9' ' ' ALA . 46.8 t -69.71 -31.11 68.94 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.201 0.524 . . . . 0.0 109.607 173.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.441 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 12.0 tp10 -57.42 -48.76 78.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.234 172.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 85' ' ' LYS . 64.7 mttt -64.9 -29.17 70.1 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.08 177.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 13.1 mt -65.56 -14.45 61.12 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.978 -0.555 . . . . 0.0 112.082 -178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.551 ' HG2' ' SG ' ' A' ' 98' ' ' CYS . 56.8 mtpt -66.4 -20.33 66.04 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.58 177.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.426 ' HB3' ' NZ ' ' A' ' 92' ' ' LYS . 3.7 mmmp? -73.16 -21.49 60.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.935 176.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 6.6 mp -97.3 -46.84 5.95 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.925 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -142.51 119.59 11.39 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.411 177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.4 m -86.74 -13.65 44.68 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.621 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -78.43 -24.77 45.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.708 -174.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.422 HG12 ' HB3' ' A' ' 58' ' ' TYR . 65.4 mt -47.08 -43.26 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.353 179.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.95 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 55.7 m -77.1 -15.67 59.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -168.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -118.84 39.35 3.54 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.658 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.528 ' HB3' HG21 ' A' ' 13' ' ' VAL . 5.6 mp -74.82 -58.61 3.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 168.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt 68.0 132.95 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.834 0.826 . . . . 0.0 112.815 172.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.625 ' CE2' ' HA ' ' A' ' 13' ' ' VAL . 93.2 m-85 -84.11 -56.07 3.86 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.047 -0.979 . . . . 0.0 111.853 -178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -117.17 19.44 14.19 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.623 -0.431 . . . . 0.0 112.104 -171.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -81.87 -50.49 9.13 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 168.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.251 1.177 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.015 175.46 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 2' ' ' GLU . 3.1 pt20 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 1' ' ' GLN . 39.7 tt0 173.38 157.0 0.12 Allowed 'General case' 0 C--O 1.234 0.239 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -171.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.08 93.54 2.41 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.236 178.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -58.56 -50.31 68.27 Favored Glycine 0 C--N 1.332 0.351 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -92.47 169.59 31.76 Favored Glycine 0 N--CA 1.442 -0.926 0 N-CA-C 109.814 -1.314 . . . . 0.0 109.814 168.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 10.2 mmt180 -133.54 63.92 66.39 Favored Pre-proline 0 C--N 1.32 -0.706 0 CA-C-N 117.814 0.807 . . . . 0.0 111.373 -177.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 6' ' ' ARG . 91.0 Cg_endo -100.42 50.86 0.05 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.19 0 C-N-CA 123.294 2.663 . . . . 0.0 111.413 177.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.607 ' O ' ' HA ' ' A' ' 84' ' ' MET . . . -71.26 -34.08 64.36 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.527 -169.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.832 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -167.52 -90.04 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.626 0.251 . . . . 0.0 111.16 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -159.32 -73.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.062 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 98' ' ' CYS . 0.6 OUTLIER -84.09 73.28 10.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.657 0.742 . . . . 0.0 112.536 -176.118 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.582 ' O ' ' HG2' ' A' ' 15' ' ' LYS . 42.2 mt-10 52.18 -104.17 0.18 Allowed 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 115.683 1.735 . . . . 0.0 115.683 167.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.523 HG12 HD12 ' A' ' 55' ' ' LEU . 19.0 t -50.17 -51.16 18.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -161.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.6 t -59.99 -29.6 68.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.332 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.832 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 7.6 ptpt -72.05 -38.83 69.43 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 109.913 -178.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.59 -43.51 98.73 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.506 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -62.62 -55.86 23.18 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.366 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.501 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 96.4 mt -62.65 -41.69 99.19 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 121.099 -0.241 . . . . 0.0 111.194 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.506 ' O ' ' HG2' ' A' ' 23' ' ' LYS . 2.8 t-20 -62.27 -55.75 25.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.508 0.195 . . . . 0.0 111.399 -176.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.19 -39.12 91.64 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' CE1' ' HA ' ' A' ' 41' ' ' LEU . 81.3 t80 -65.91 -49.73 66.96 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.242 0.544 . . . . 0.0 110.648 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.696 ' HE2' ' H ' ' A' ' 81' ' ' MET . 67.7 t80 -54.39 -37.18 64.74 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.629 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.7 mmmt -81.06 -47.05 14.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.326 178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.8 t -56.11 -33.57 65.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.194 -176.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.766 ' HG ' HG23 ' A' ' 30' ' ' VAL . 2.4 tp -73.65 -33.2 64.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.941 0.4 . . . . 0.0 110.531 -176.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 22' ' ' TYR . 25.1 mm -79.99 -34.99 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.5 -43.3 99.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.685 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -71.72 -21.09 61.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.91 177.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.28 22.72 43.31 Favored Glycine 0 CA--C 1.508 -0.362 0 C-N-CA 120.993 -0.623 . . . . 0.0 111.814 175.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.766 HG23 ' HG ' ' A' ' 25' ' ' LEU . 32.6 m -105.48 -136.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 CA-C-N 115.095 -0.552 . . . . 0.0 109.802 -177.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.505 HD22 HG12 ' A' ' 37' ' ' ILE . 2.5 t-20 74.1 -177.89 0.17 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.374 0.67 . . . . 0.0 111.444 175.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.437 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 53.1 t80 73.87 -57.12 0.63 Allowed 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.136 0.974 . . . . 0.0 111.453 -177.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.583 ' O ' HG13 ' A' ' 37' ' ' ILE . 4.1 m -67.39 114.32 5.98 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 84.5 mt -55.03 -41.12 70.97 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.801 -177.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.66 -39.14 92.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.477 0.656 . . . . 0.0 110.144 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.561 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 22.1 m -74.1 -41.67 61.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.5 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.587 HG22 HG22 ' A' ' 74' ' ' THR . 61.5 mt -59.39 -33.96 52.84 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.61 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -66.83 -54.05 26.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.892 177.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -56.92 -52.88 63.43 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.152 -177.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.578 ' OE2' HG21 ' A' ' 30' ' ' VAL . 11.3 mt-10 -74.62 -20.76 59.77 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.805 -175.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.629 ' HG ' ' HB1' ' A' ' 61' ' ' ALA . 42.5 tp -63.4 -45.56 90.5 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 172.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.51 -46.9 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.317 177.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.483 ' HB2' ' HA ' ' A' ' 40' ' ' GLU . 58.4 m -55.34 -52.1 64.6 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.461 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -63.82 -44.92 91.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.373 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 8.1 t -64.42 -43.68 93.59 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -175.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 46' ' ' LEU . 4.4 mm? -78.44 -14.31 59.43 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.002 0.429 . . . . 0.0 111.003 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.4 -23.03 40.68 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.572 177.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -74.3 -165.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.797 179.033 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -93.91 170.31 9.65 Favored 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.385 -0.197 . . . . 0.0 111.268 -176.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -52.78 -45.04 61.09 Favored Glycine 0 C--N 1.329 0.188 0 CA-C-N 115.889 -0.596 . . . . 0.0 114.565 -168.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tppt? -59.07 -41.68 88.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.444 0.64 . . . . 0.0 110.328 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.533 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 18.1 mt-10 -77.41 -34.7 54.69 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.263 -177.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -62.29 -50.41 71.77 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' HD2' ' HD2' ' A' ' 57' ' ' TYR . 13.7 tpt180 -61.08 -34.32 74.73 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.102 -0.953 . . . . 0.0 111.18 -177.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.921 HD22 ' HG ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -52.02 -37.96 55.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.84 -179.592 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.788 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 82.0 m -72.19 -14.48 61.81 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -171.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.426 ' HD2' ' HD2' ' A' ' 54' ' ' ARG . 63.2 m-85 -68.56 -34.34 75.65 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.581 ' HB3' HG12 ' A' ' 97' ' ' ILE . 28.2 m-85 -87.27 -42.3 13.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.422 176.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.921 ' HG ' HD22 ' A' ' 55' ' ' LEU . 31.0 mt -60.95 -34.43 74.72 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.365 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.652 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 103.65 -7.01 49.45 Favored Glycine 0 N--CA 1.445 -0.752 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.956 -178.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.629 ' HB1' ' HG ' ' A' ' 41' ' ' LEU . . . -76.23 48.2 0.5 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.365 0.602 . . . . 0.0 111.488 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.5 m -155.2 120.67 4.99 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -80.97 41.21 0.57 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.324 0.583 . . . . 0.0 111.091 -175.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -130.43 -6.76 4.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.268 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.84 -152.43 0.5 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.674 -175.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.41 125.17 22.67 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.947 0.403 . . . . 0.0 110.321 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.0 p -80.35 -33.54 37.26 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.066 -172.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.515 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 52.8 tttp -66.9 -42.74 84.97 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.368 -177.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.652 HG23 ' HA3' ' A' ' 60' ' ' GLY . 18.0 tt -64.68 -28.39 44.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.814 0.34 . . . . 0.0 110.937 -177.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.6 tt -61.06 -47.8 84.67 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 172.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.525 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 14.7 m -64.51 -34.67 78.76 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.463 177.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 68' ' ' LYS . 51.7 mm-40 -62.77 -23.87 67.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.259 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 77' ' ' MET . 59.8 t -87.66 -56.07 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.205 0.526 . . . . 0.0 110.713 172.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.587 HG22 HG22 ' A' ' 37' ' ' ILE . 20.7 p -59.22 -37.04 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -172.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.525 ' HD3' ' O ' ' A' ' 71' ' ' SER . 10.6 mpt_? -64.53 -54.82 34.17 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 119.395 -0.336 . . . . 0.0 111.581 -176.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -62.09 -35.16 77.45 Favored 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 121.224 1.283 . . . . 0.0 111.462 173.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.521 ' HB3' HG21 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -62.5 -13.31 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.898 -179.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.498 ' HA ' HD11 ' A' ' 37' ' ' ILE . 29.2 t -62.14 -26.33 68.25 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.212 0.53 . . . . 0.0 110.476 177.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 8.4 p -123.57 152.9 28.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -58.11 120.34 8.43 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 1.4 mmt -125.5 149.85 66.05 Favored Pre-proline 0 C--N 1.325 -0.457 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -161.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 66.7 Cg_exo -43.88 2.21 0.01 OUTLIER 'Trans proline' 0 N--CA 1.479 0.668 1 C-N-CA 127.27 5.314 . . . . 0.0 116.406 165.04 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.514 ' HA ' ' CG1' ' A' ' 86' ' ' ILE . . . -37.98 -22.5 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 117.251 2.315 . . . . 0.0 117.251 -158.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.607 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -48.13 -40.6 24.14 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 118.538 0.608 . . . . 0.0 110.223 164.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -87.22 -23.43 24.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.207 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.514 ' CG1' ' HA ' ' A' ' 83' ' ' ALA . 60.3 mt -64.36 -33.9 65.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.96 0.409 . . . . 0.0 110.362 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.501 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 49.0 t -64.71 -30.16 71.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.4 0.619 . . . . 0.0 110.528 176.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -73.26 -32.9 64.96 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.927 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -60.64 -40.54 92.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.38 0.609 . . . . 0.0 109.7 173.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.581 ' HA ' HD13 ' A' ' 93' ' ' LEU . 94.4 mt -69.14 -17.67 63.86 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.384 -178.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.56 ' HD3' ' SG ' ' A' ' 98' ' ' CYS . 13.9 mmmm -65.26 -21.9 66.79 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.953 0.406 . . . . 0.0 110.664 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -77.45 -27.31 52.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.171 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.581 HD13 ' HA ' ' A' ' 90' ' ' LEU . 6.2 mp -83.43 -45.8 13.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.838 177.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.647 ' HB3' HG13 ' A' ' 97' ' ' ILE . 10.7 t70 -154.09 129.82 10.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.55 177.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 11.3 t -82.47 -35.61 27.28 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.019 -176.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.496 ' HA ' ' HB2' ' A' ' 99' ' ' GLU . 27.2 tt0 -69.94 -12.9 61.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.253 -174.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.647 HG13 ' HB3' ' A' ' 94' ' ' ASP . 38.2 mt -43.76 -55.17 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.601 178.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.58 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 26.6 p -91.94 -19.13 22.76 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.669 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.496 ' HB2' ' HA ' ' A' ' 96' ' ' GLN . 42.8 mt-10 -88.71 17.32 5.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.372 -175.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.58 HD12 ' HG ' ' A' ' 55' ' ' LEU . 74.7 mt -62.26 -42.37 99.27 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 173.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.448 ' HE2' ' HA ' ' A' ' 99' ' ' GLU . 56.4 mmtt 68.76 141.06 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.084 0.865 . . . . 0.0 111.605 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -76.61 70.76 3.16 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.959 176.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 68.79 105.28 0.05 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.29 -177.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -82.67 77.11 9.47 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.254 -178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.842 -179.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.451 ' HB3' ' HG2' ' A' ' 20' ' ' ARG . 79.0 mt-30 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.776 ' HG2' ' H ' ' A' ' 4' ' ' GLY . 35.2 tt0 72.99 150.12 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.957 0.786 . . . . 0.0 111.099 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.733 ' HB3' ' HG2' ' A' ' 7' ' ' PRO . . . -114.44 4.75 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.181 178.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.776 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . 112.27 92.22 2.04 Favored Glycine 0 CA--C 1.519 0.287 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.979 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.94 19.9 18.08 Favored Glycine 0 N--CA 1.454 -0.124 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.377 177.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.426 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 18.3 mmm180 53.29 59.44 13.13 Favored Pre-proline 0 N--CA 1.468 0.427 0 C-N-CA 122.871 0.469 . . . . 0.0 110.862 -177.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.733 ' HG2' ' HB3' ' A' ' 3' ' ' ALA . 2.0 Cg_endo -84.93 55.65 4.34 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 123.063 2.509 . . . . 0.0 111.351 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.929 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -90.46 -35.5 7.39 Favored Glycine 0 N--CA 1.441 -1.022 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.456 -173.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 173.26 -149.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -174.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -123.39 -24.44 4.62 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.483 0.658 . . . . 0.0 109.81 178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.65 ' HB3' ' HA ' ' A' ' 98' ' ' CYS . 21.2 m -76.55 1.02 17.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.832 -175.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' CA ' ' HB3' ' A' ' 15' ' ' LYS . 26.4 tp10 69.55 -74.3 0.08 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.942 171.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.684 ' HB ' ' O ' ' A' ' 101' ' ' LYS . 6.6 p -57.83 -46.77 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 CA-C-O 121.639 0.733 . . . . 0.0 109.727 178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' HD21 ' A' ' 55' ' ' LEU . 8.4 t -68.45 -31.67 71.14 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.023 -0.99 . . . . 0.0 110.302 176.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.593 ' O ' ' HA3' ' A' ' 8' ' ' GLY . 9.9 ttmt -59.24 -53.25 60.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.332 176.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.602 ' HG3' ' OH ' ' A' ' 102' ' ' TYR . 22.4 mm-40 -55.21 -49.98 70.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.057 -179.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -62.02 -55.04 33.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.576 -178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 87' ' ' CYS . 85.7 mt -56.7 -53.84 53.1 Favored 'General case' 0 C--O 1.223 -0.295 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -173.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.929 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 16.3 t-20 -67.44 -40.09 85.41 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.397 -173.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.586 HH22 HG22 ' A' ' 48' ' ' THR . 35.6 mtp180 -65.03 -43.34 92.72 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.588 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.529 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 55.0 t80 -64.37 -47.27 79.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.3 0.572 . . . . 0.0 109.829 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -51.57 -42.17 61.67 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.648 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 30.5 mmmt -84.09 -37.76 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.653 -0.248 . . . . 0.0 111.508 -179.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -60.5 -32.27 71.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.156 -178.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 22.9 mt -70.56 -27.92 64.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.022 0.439 . . . . 0.0 110.77 -178.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 27.9 mm -80.18 -48.68 19.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.38 -44.91 95.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.452 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.434 ' HB2' HG12 ' A' ' 30' ' ' VAL . 62.8 mtp180 -79.43 -13.79 59.36 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.09 28.76 59.81 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.046 178.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.48 HG21 ' HG3' ' A' ' 40' ' ' GLU . 1.4 p -124.23 92.97 2.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.171 0.51 . . . . 0.0 109.858 -175.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -158.87 178.62 9.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.855 -174.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 78' ' ' SER . 25.6 t80 75.91 -55.39 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.462 1.105 . . . . 0.0 112.301 175.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.725 ' HB2' ' HB ' ' A' ' 36' ' ' THR . 8.6 m -60.79 118.39 6.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.083 0.468 . . . . 0.0 110.91 -177.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.27 -41.72 89.52 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.578 -174.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.61 -26.14 60.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.255 0.55 . . . . 0.0 110.081 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 33' ' ' SER . 18.7 m -74.77 -45.49 43.42 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.302 179.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.616 HG21 ' HA ' ' A' ' 74' ' ' THR . 21.9 mm -58.45 -34.29 50.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -64.41 -52.18 59.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.75 177.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.746 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -57.42 -37.31 72.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.775 179.169 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.48 ' HG3' HG21 ' A' ' 30' ' ' VAL . 59.1 mm-40 -85.13 -28.63 25.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.849 -174.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.1 mt -59.44 -42.5 92.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 170.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.1 mt -61.48 -52.19 64.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.843 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -65.04 -44.71 88.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.955 -176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -70.84 -27.02 63.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.47 . . . . 0.0 110.287 -176.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 11.5 t -62.95 -25.66 68.46 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.981 176.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -85.83 -37.5 19.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -83.47 56.41 3.57 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.563 0.697 . . . . 0.0 110.365 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.788 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -153.99 -173.4 4.56 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.487 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -97.35 171.89 8.12 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.416 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.21 29.9 Favored Glycine 0 C--N 1.331 0.252 0 O-C-N 123.603 0.565 . . . . 0.0 114.039 -173.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.76 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 0.6 OUTLIER -56.98 -43.87 82.09 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.951 0.405 . . . . 0.0 110.888 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.788 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 12.5 mt-10 -82.64 -32.84 28.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.97 -176.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -61.04 -37.1 81.4 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 18.7 tpt180 -82.07 -32.61 30.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.071 176.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.834 ' HA ' ' CZ ' ' A' ' 58' ' ' TYR . 34.9 tp -50.08 -46.94 53.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.236 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.446 ' SG ' HG23 ' A' ' 62' ' ' THR . 1.6 p -63.72 -17.78 63.35 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.722 -174.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 33.8 m-85 -62.75 -51.0 68.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 176.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.834 ' CZ ' ' HA ' ' A' ' 55' ' ' LEU . 1.8 p90 -87.32 -17.52 32.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.23 -175.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 31.2 mt -78.08 -31.1 49.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.98 0.419 . . . . 0.0 110.741 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.443 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 106.27 91.31 2.21 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.872 -178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -160.06 -53.48 0.05 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.115 0.484 . . . . 0.0 110.044 178.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.446 HG23 ' SG ' ' A' ' 56' ' ' CYS . 2.9 p -82.3 139.35 34.22 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.58 178.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -81.81 6.35 15.87 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.329 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -90.17 5.8 45.37 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.539 175.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -139.54 -152.06 0.4 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.888 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.26 110.88 2.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.153 0.501 . . . . 0.0 110.908 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.9 p -84.99 -19.01 32.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.456 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -71.96 -47.33 53.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.232 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.524 HD11 HD22 ' A' ' 90' ' ' LEU . 14.5 tt -65.83 -16.94 21.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.11 -176.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 3.3 tt -54.17 -46.32 72.32 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.329 0.585 . . . . 0.0 109.624 174.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.415 ' HA ' ' OG1' ' A' ' 74' ' ' THR . 7.1 m -67.89 -25.13 65.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.791 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -73.51 -18.17 61.13 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.761 -179.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 76' ' ' PRO . 44.5 t -88.54 -47.67 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.166 0.507 . . . . 0.0 110.848 171.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.616 ' HA ' HG21 ' A' ' 37' ' ' ILE . 55.9 p -59.06 -39.6 82.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.453 -174.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 78' ' ' SER . 0.3 OUTLIER -61.31 -55.52 42.77 Favored Pre-proline 0 CA--C 1.536 0.41 0 C-N-CA 120.89 -0.324 . . . . 0.0 111.827 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.636 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 11.8 Cg_endo -61.05 -42.09 39.05 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 121.223 1.282 . . . . 0.0 112.742 177.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mmt -64.28 -20.69 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.676 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 33.6 t -60.36 -27.26 67.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.485 178.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.893 HG13 ' H ' ' A' ' 80' ' ' HIS . 4.7 p -127.5 -87.32 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.001 178.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.893 ' H ' HG13 ' A' ' 79' ' ' VAL . 39.3 m80 -150.69 -80.06 0.12 Allowed 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 177.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 76' ' ' PRO . 35.1 mtp 68.81 167.4 0.12 Allowed Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 168.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.574 ' HB2' HG13 ' A' ' 86' ' ' ILE . 18.4 Cg_exo -40.65 -0.89 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.218 1 C-N-CA 127.553 5.502 . . . . 0.0 118.977 177.87 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.595 ' HA ' ' HB ' ' A' ' 86' ' ' ILE . . . -34.73 -46.23 0.28 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -156.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.695 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -52.13 -53.71 39.38 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.327 1.06 . . . . 0.0 109.644 174.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 34.2 tttp -76.29 -18.02 59.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.046 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.993 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 20.1 mt -60.67 -40.57 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.353 0 O-C-N 122.136 -0.352 . . . . 0.0 110.255 175.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.429 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 14.8 t -67.04 -19.98 65.77 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.172 0.51 . . . . 0.0 110.698 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 41.5 mt-10 -78.65 -40.23 34.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.448 0.642 . . . . 0.0 109.836 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.993 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.2 mtmp? -67.83 -30.78 70.27 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.115 178.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 69' ' ' ILE . 18.6 mt -66.81 -17.2 64.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.571 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.615 ' HG2' ' HB2' ' A' ' 98' ' ' CYS . 45.1 mtpt -68.71 -14.31 62.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.319 -177.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 89' ' ' LYS . 34.0 mtmm -62.04 -39.27 91.77 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.014 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 94' ' ' ASP . 5.9 mp -91.01 71.73 6.4 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.58 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 93' ' ' LEU . 27.9 m-20 72.06 105.21 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.012 -175.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.2 m -70.42 -13.54 62.17 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.029 -179.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -49.83 -34.41 19.71 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.926 176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.581 HG23 ' HD2' ' A' ' 58' ' ' TYR . 73.3 mt -52.66 -31.14 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.536 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.65 ' HA ' ' HB3' ' A' ' 11' ' ' CYS . 5.0 t -86.54 -18.69 30.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.631 -173.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -111.12 52.38 0.74 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.439 0.638 . . . . 0.0 111.322 -171.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.567 HD22 ' OH ' ' A' ' 58' ' ' TYR . 1.5 mp -103.02 -45.05 5.06 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.889 169.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.684 ' O ' ' HB ' ' A' ' 13' ' ' VAL . 29.6 mmtp 64.33 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.248 -178.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.76 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.4 m-85 -164.22 -97.59 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 170.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -99.48 -52.68 3.42 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 161.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.549 ' HD3' ' HA ' ' A' ' 104' ' ' LYS . 2.0 mmtm 179.72 -42.46 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 113.951 -1.477 . . . . 0.0 109.022 169.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 105' ' ' THR . 6.0 t . . . . . 0 C--O 1.248 1.022 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.863 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.618 ' O ' ' HG2' ' A' ' 2' ' ' GLU . 9.2 mm100 . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 110.67 -0.122 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.675 ' HA ' ' HD3' ' A' ' 20' ' ' ARG . 11.3 pt-20 55.82 -176.3 0.05 OUTLIER 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.439 1.095 . . . . 0.0 111.945 174.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.17 -0.85 15.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.071 177.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.464 ' H ' ' HG3' ' A' ' 2' ' ' GLU . . . -64.64 103.5 0.77 Allowed Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.523 176.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 121.23 -15.9 9.29 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 121.004 -0.617 . . . . 0.0 111.877 -177.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.452 ' HB2' ' CD ' ' A' ' 7' ' ' PRO . 28.5 ptt180 -138.64 168.32 16.23 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 -178.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.452 ' CD ' ' HB2' ' A' ' 6' ' ' ARG . 11.9 Cg_endo -92.07 91.23 0.21 Allowed 'Trans proline' 0 N--CA 1.445 -1.359 0 C-N-CA 122.857 2.372 . . . . 0.0 111.117 -171.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.901 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -72.33 -37.95 58.79 Favored Glycine 0 N--CA 1.439 -1.112 0 C-N-CA 119.601 -1.285 . . . . 0.0 111.936 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.991 ' HA ' ' HA ' ' A' ' 84' ' ' MET . . . -173.7 -83.1 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.405 -0.398 . . . . 0.0 110.413 -176.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -162.67 -67.54 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.816 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' H ' ' A' ' 12' ' ' GLU . 5.4 m -57.52 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.679 0.612 . . . . 0.0 112.084 -175.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HA ' ' OE1' ' A' ' 12' ' ' GLU . 4.4 tp10 -170.35 -75.98 0.02 OUTLIER 'General case' 0 C--O 1.22 -0.495 0 O-C-N 122.063 -0.398 . . . . 0.0 111.055 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' ' 100' ' ' LEU . 38.9 t -55.6 -43.06 71.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.712 0.767 . . . . 0.0 109.968 179.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' HD21 ' A' ' 55' ' ' LEU . 37.1 t -61.2 -36.16 79.12 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.172 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.64 ' HB2' ' N ' ' A' ' 9' ' ' ALA . 3.2 ptpp? -77.91 -32.84 51.96 Favored 'General case' 0 N--CA 1.458 -0.052 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.11 -177.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 56.9 mm-40 -57.84 -52.5 65.24 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.523 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -61.78 -55.16 32.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.336 -177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 9' ' ' ALA . 82.9 mt -61.37 -46.08 91.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 121.335 -0.146 . . . . 0.0 111.207 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.901 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 24.4 t-20 -62.06 -52.95 61.86 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.987 0.179 . . . . 0.0 111.327 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.675 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 51.1 mtm-85 -65.4 -41.86 93.21 Favored 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 120.939 -0.304 . . . . 0.0 111.562 -177.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -59.05 -49.13 79.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.831 0.824 . . . . 0.0 109.584 178.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.537 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 70.0 t80 -53.73 -55.35 27.04 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.256 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -67.39 -34.02 76.41 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 74.7 m -62.3 -33.9 75.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.933 0.397 . . . . 0.0 111.271 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 2.6 mp -77.46 -39.83 45.23 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 47.2 mm -65.35 -45.84 92.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.246 0.546 . . . . 0.0 109.772 175.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -60.71 -51.53 68.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.569 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.735 ' HB2' HG12 ' A' ' 30' ' ' VAL . 90.2 mtm-85 -78.25 -13.47 59.84 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -176.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 74.8 25.87 68.51 Favored Glycine 0 CA--C 1.509 -0.322 0 N-CA-C 110.73 -0.948 . . . . 0.0 110.73 -176.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.744 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 4.0 p -109.28 57.91 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 122.425 1.107 . . . . 0.0 109.683 -173.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.533 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 2.7 t-20 -140.7 -179.09 5.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.06 -172.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.437 ' H ' ' ND2' ' A' ' 31' ' ' ASN . 44.8 t80 73.09 -55.84 0.67 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.254 1.021 . . . . 0.0 111.329 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.484 ' O ' HG13 ' A' ' 37' ' ' ILE . 22.3 m -60.52 109.75 1.1 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.834 0.349 . . . . 0.0 110.644 178.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.654 HD11 ' HA ' ' A' ' 75' ' ' ARG . 3.3 mm? -59.66 -38.88 82.67 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.858 -175.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -61.15 -38.39 86.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.311 0.577 . . . . 0.0 110.626 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.3 m -76.43 -41.65 46.81 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.196 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 33' ' ' SER . 61.1 mt -60.44 -32.3 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -63.13 -50.56 69.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.509 175.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.1 tptt -62.95 -35.2 79.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.844 178.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -74.2 -36.74 64.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.67 -178.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.446 HD12 HG23 ' A' ' 74' ' ' THR . 17.1 mt -58.36 -38.78 77.91 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 172.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.773 HG12 ' HA ' ' A' ' 62' ' ' THR . 96.1 mt -65.43 -49.3 79.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.905 176.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -63.64 -55.36 24.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.031 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -61.68 -29.45 70.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.666 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.553 ' O ' ' HA ' ' A' ' 53' ' ' ASN . 2.5 t -54.23 -50.77 66.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 175.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.1 mt -88.42 -14.57 37.68 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.812 0.339 . . . . 0.0 111.833 -176.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -94.93 -1.74 51.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.185 0.517 . . . . 0.0 111.385 -174.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.796 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.6 OUTLIER -85.58 -161.71 0.64 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.856 177.025 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 73.5 mmtt -93.87 169.54 10.22 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.627 ' O ' ' HG2' ' A' ' 54' ' ' ARG . . . -46.73 -52.24 11.68 Favored Glycine 0 N--CA 1.453 -0.176 0 O-C-N 123.769 0.668 . . . . 0.0 114.26 -170.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -63.72 -39.93 95.52 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.244 0.522 . . . . 0.0 110.821 -179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.796 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 50.3 mt-10 -72.21 -31.19 65.65 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.515 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 45' ' ' CYS . 12.9 m120 -66.79 -21.05 66.05 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.667 175.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 50' ' ' GLY . 7.0 mmm180 -86.01 -44.6 12.18 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 172.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.585 HD11 HG23 ' A' ' 97' ' ' ILE . 27.8 tp -59.58 -24.87 64.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.427 -1.26 . . . . 0.0 112.598 -172.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 7.6 p -63.84 -34.85 78.85 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.536 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.0 m-85 -74.84 -17.09 60.65 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.147 0.498 . . . . 0.0 110.003 176.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.579 ' HB3' HG12 ' A' ' 97' ' ' ILE . 63.0 m-85 -85.41 -51.59 6.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.759 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 70.0 mt -61.29 -46.65 89.42 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.962 -178.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.553 ' O ' ' HA ' ' A' ' 70' ' ' LEU . . . 131.9 59.78 0.09 OUTLIER Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.968 -178.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -128.85 169.53 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.773 ' HA ' HG12 ' A' ' 42' ' ' ILE . 16.9 p 66.21 142.66 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.295 1.038 . . . . 0.0 111.65 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.448 ' HB3' ' NZ ' ' A' ' 63' ' ' LYS . 9.3 mtpm? -90.73 19.05 5.75 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.641 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -93.12 -27.81 16.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.814 176.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -101.81 -167.28 1.39 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.273 178.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -52.73 119.93 5.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.055 0.455 . . . . 0.0 110.991 178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.26 -16.16 44.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.667 -176.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 72' ' ' GLU . 27.5 ttpp -62.73 -51.94 65.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.858 0.361 . . . . 0.0 110.35 177.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 72' ' ' GLU . 8.5 tp -65.88 -25.73 36.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.697 -179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.553 ' HA ' ' O ' ' A' ' 60' ' ' GLY . 2.8 tt -61.4 -45.08 95.86 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 175.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.502 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 45.3 m -66.68 -35.14 79.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.304 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.476 ' HB2' HD12 ' A' ' 69' ' ' ILE . 42.4 mt-10 -68.86 -23.42 64.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.756 -177.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.482 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 91.6 t -88.01 -48.53 15.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 120.774 0.321 . . . . 0.0 111.371 174.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.446 HG23 HD12 ' A' ' 41' ' ' LEU . 7.9 p -54.02 -47.27 71.7 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -176.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.654 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.1 mpt_? -58.09 -53.29 67.45 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 119.433 -0.318 . . . . 0.0 111.745 -177.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.551 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 52.7 Cg_exo -56.74 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 121.78 1.654 . . . . 0.0 113.1 174.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.5 mmt -62.69 -14.05 39.47 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.823 0.344 . . . . 0.0 111.749 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 75' ' ' ARG . 31.5 t -74.27 -14.87 60.97 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.262 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.647 HG22 ' H ' ' A' ' 80' ' ' HIS . 4.4 p -136.18 -178.15 2.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.647 ' H ' HG22 ' A' ' 79' ' ' VAL . 60.0 t-80 -56.09 -64.29 0.91 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 117.869 0.304 . . . . 0.0 110.336 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.869 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 0.0 OUTLIER 67.04 146.39 0.11 Allowed Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 168.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.869 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 51.7 Cg_exo -41.87 0.99 0.0 OUTLIER 'Trans proline' 0 C--O 1.21 -0.878 1 C-N-CA 126.838 5.025 . . . . 0.0 117.723 167.039 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.567 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -36.1 -34.53 0.06 Allowed 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -159.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.991 ' HA ' ' HA ' ' A' ' 9' ' ' ALA . 1.1 mpp? -55.88 -56.64 18.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.872 0.844 . . . . 0.0 109.559 171.128 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 82' ' ' PRO . 44.4 mttm -68.54 -19.87 64.52 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.616 -1.174 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.567 HD12 ' HA ' ' A' ' 83' ' ' ALA . 24.7 mt -60.87 -29.63 45.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.046 179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.546 ' CB ' ' HB1' ' A' ' 9' ' ' ALA . 46.0 t -72.04 -34.34 68.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.428 0.632 . . . . 0.0 110.026 176.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.596 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 51.0 mt-10 -69.09 -41.12 77.91 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.681 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 86' ' ' ILE . 0.4 OUTLIER -76.11 -28.21 57.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.669 177.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 90' ' ' LEU . 6.9 mt -67.63 -28.15 67.48 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.995 176.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.596 ' HD3' ' HA ' ' A' ' 88' ' ' GLU . 25.7 mtpp -60.75 -22.73 64.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.958 176.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -79.15 -13.89 59.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.374 179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.2 mp -100.21 -49.57 4.23 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.647 174.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -142.09 118.78 11.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.906 178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.2 p -85.65 -15.11 43.48 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.798 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -71.13 -29.99 65.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.497 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.585 HG23 HD11 ' A' ' 55' ' ' LEU . 95.4 mt -50.87 -40.36 20.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.907 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.426 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 49.6 t -71.36 -52.26 19.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.357 -174.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -97.2 36.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.717 -171.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.597 ' O ' HG21 ' A' ' 13' ' ' VAL . 10.1 tp -84.65 37.25 0.63 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 104' ' ' LYS . 34.0 mmtp -54.02 145.54 16.51 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.625 -172.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -63.0 114.2 3.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.351 -173.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 58.08 35.74 25.39 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.57 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 101' ' ' LYS . 16.2 tppt? -87.37 72.95 9.7 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 171.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.5 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.461 -173.122 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.661 ' HB3' ' HE3' ' A' ' 23' ' ' LYS . 9.6 tp10 -154.95 148.27 25.03 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.392 -176.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 1.049 ' HB2' ' HD2' ' A' ' 20' ' ' ARG . . . -153.46 -153.62 0.48 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.15 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 90.06 101.6 1.13 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.029 174.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.51 60.02 9.72 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 121.312 -0.47 . . . . 0.0 112.17 177.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.41 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 36.3 mmt180 -111.31 154.02 43.83 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 120.68 0.276 . . . . 0.0 111.604 -172.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 6' ' ' ARG . 84.3 Cg_endo -97.2 64.08 0.11 Allowed 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.916 3.077 . . . . 0.0 111.846 176.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.841 ' H ' ' HD3' ' A' ' 15' ' ' LYS . . . -73.08 -42.64 43.17 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.107 -176.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.664 ' N ' ' HB2' ' A' ' 15' ' ' LYS . . . -166.92 -82.68 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.175 0.512 . . . . 0.0 110.963 -172.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -162.16 -62.53 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.319 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' SG ' ' HB3' ' A' ' 14' ' ' CYS . 4.8 p -77.76 148.13 34.98 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.24 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -58.91 -72.08 0.11 Allowed 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -172.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.838 HG22 HD22 ' A' ' 55' ' ' LEU . 6.1 p -51.38 -48.65 33.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -170.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.468 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 33.9 t -62.97 -43.18 99.51 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.924 0.392 . . . . 0.0 110.877 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.841 ' HD3' ' H ' ' A' ' 8' ' ' GLY . 5.2 ptpp? -72.32 -42.13 65.75 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.578 -175.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.61 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 37.0 mm-40 -57.88 -42.73 85.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.535 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -60.0 -51.46 69.57 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.418 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 66.5 mt -60.34 -45.04 94.87 Favored 'General case' 0 N--CA 1.444 -0.736 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -50.92 -56.39 12.58 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 123.52 0.512 . . . . 0.0 112.109 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 1.049 ' HD2' ' HB2' ' A' ' 3' ' ' ALA . 0.9 OUTLIER -58.67 -55.24 37.65 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.719 -177.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.563 ' CZ ' ' HG ' ' A' ' 41' ' ' LEU . 69.2 t80 -59.08 -48.22 82.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.203 0.525 . . . . 0.0 111.073 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.405 ' HB2' ' O ' ' A' ' 18' ' ' LEU . 46.4 t80 -53.3 -48.41 68.41 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.761 -1.109 . . . . 0.0 112.188 -174.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.661 ' HE3' ' HB3' ' A' ' 2' ' ' GLU . 0.0 OUTLIER -85.69 -39.26 17.42 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.504 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -61.96 -32.44 72.87 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.761 0.315 . . . . 0.0 111.356 -178.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.752 ' HG ' ' O ' ' A' ' 30' ' ' VAL . 11.5 tp -61.63 -41.94 98.19 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.307 0.575 . . . . 0.0 109.992 177.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 26.3 mm -75.26 -38.06 40.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.455 -177.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -59.14 -45.91 89.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.596 175.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -70.08 -23.7 63.11 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.051 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.36 -5.58 67.84 Favored Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.985 -0.626 . . . . 0.0 111.657 174.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.752 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -86.48 122.41 38.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.048 -0.576 . . . . 0.0 110.201 179.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -172.03 -177.99 2.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 174.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.465 ' HA ' ' OG ' ' A' ' 78' ' ' SER . 94.9 m-85 71.19 -58.36 0.58 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.628 0.771 . . . . 0.0 112.145 178.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.436 ' O ' HG13 ' A' ' 37' ' ' ILE . 12.5 m -64.2 109.07 1.74 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.847 0.356 . . . . 0.0 110.15 178.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.579 HD11 ' HA ' ' A' ' 75' ' ' ARG . 2.6 mm? -59.86 -37.74 80.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.874 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.08 -36.57 82.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.54 0.686 . . . . 0.0 110.045 178.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.409 HG22 ' CG2' ' A' ' 30' ' ' VAL . 56.6 m -80.09 -38.78 31.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.49 -177.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 33' ' ' SER . 72.1 mt -62.89 -34.75 67.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -72.96 -38.74 66.64 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.554 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.3 tmmm? -58.49 -47.73 83.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.499 175.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.635 ' HG3' HG21 ' A' ' 30' ' ' VAL . 6.7 mm-40 -68.47 -41.42 80.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.526 -176.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.563 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 13.6 mt -55.79 -44.9 78.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 175.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.486 HD13 ' HD3' ' A' ' 63' ' ' LYS . 69.1 mt -62.7 -52.41 60.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.138 178.282 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 63.1 m -58.94 -47.34 85.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.959 0.409 . . . . 0.0 111.21 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.626 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 30.2 t80 -65.84 -36.25 82.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.746 -176.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 61' ' ' ALA . 6.5 m -69.33 -33.29 72.9 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 68.8 mt -85.29 -31.7 22.92 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.373 -0.531 . . . . 0.0 109.938 177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -91.25 70.02 6.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.72 0.771 . . . . 0.0 110.305 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -159.1 -162.33 1.06 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.284 177.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -95.64 170.41 9.35 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.286 -0.566 . . . . 0.0 111.145 179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.53 -48.37 60.8 Favored Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.3 -0.864 . . . . 0.0 114.174 -169.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 102' ' ' TYR . 11.5 mptt -67.44 -25.74 66.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.448 0.624 . . . . 0.0 111.562 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.45 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 36.5 mt-10 -77.97 -49.38 14.21 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 176.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -58.16 -40.59 81.8 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.467 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 54' ' ' ARG . 27.2 tpt85 -69.97 -40.35 75.44 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.214 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.838 HD22 HG22 ' A' ' 13' ' ' VAL . 43.8 tp -61.25 -34.09 74.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.092 -178.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.579 ' HA ' ' HB2' ' A' ' 59' ' ' LEU . 64.4 m -68.41 -14.71 63.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -176.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -67.7 -29.32 68.55 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 171.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -85.54 -39.3 17.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.092 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 56' ' ' CYS . 66.8 mt -67.33 -31.93 72.54 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.183 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.523 ' HA3' HG23 ' A' ' 69' ' ' ILE . . . 109.31 -18.13 30.79 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.873 176.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.533 ' HB3' ' SG ' ' A' ' 45' ' ' CYS . . . -80.58 67.46 6.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.457 0.646 . . . . 0.0 111.393 -177.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.533 HG22 ' H ' ' A' ' 64' ' ' ASP . 25.0 m -155.15 145.7 22.17 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HD3' HD13 ' A' ' 42' ' ' ILE . 31.9 mmmt -76.46 2.97 12.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.261 0.553 . . . . 0.0 110.858 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.533 ' H ' HG22 ' A' ' 62' ' ' THR . 19.9 m-20 -125.27 29.34 6.09 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.334 171.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.28 170.84 14.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.464 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -77.51 117.46 18.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.047 -178.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.491 ' HA ' ' HB3' ' A' ' 70' ' ' LEU . 39.7 p -73.37 -14.1 61.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.712 -178.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -58.67 -56.33 23.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.62 0.248 . . . . 0.0 110.728 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.523 HG23 ' HA3' ' A' ' 60' ' ' GLY . 14.5 tt -69.23 -25.73 30.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.042 0.449 . . . . 0.0 110.377 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.491 ' HB3' ' HA ' ' A' ' 67' ' ' THR . 20.2 tp -60.24 -48.67 80.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.686 174.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 20.8 m -66.05 -29.28 69.61 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.989 0.423 . . . . 0.0 110.494 177.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.41 -21.43 66.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.965 175.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 57.3 t -87.65 -45.0 16.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 120.809 0.338 . . . . 0.0 111.35 175.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 28.7 p -57.72 -41.5 81.88 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -175.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.579 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.5 mpt_? -59.01 -54.97 51.22 Favored Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.611 -179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.586 ' HA ' ' HG3' ' A' ' 81' ' ' MET . 50.5 Cg_exo -56.6 -43.13 58.03 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.946 1.764 . . . . 0.0 113.24 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 20.3 mmt -62.91 -13.75 38.25 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.465 ' OG ' ' HA ' ' A' ' 32' ' ' PHE . 40.6 t -69.64 -12.31 61.54 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.574 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.786 HG22 ' H ' ' A' ' 80' ' ' HIS . 6.5 p -153.73 -166.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.786 ' H ' HG22 ' A' ' 79' ' ' VAL . 36.4 t-80 -60.54 -71.8 0.13 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.886 0.312 . . . . 0.0 110.911 -176.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.762 ' SD ' ' HD2' ' A' ' 82' ' ' PRO . 48.8 mmm 64.24 158.0 0.12 Allowed Pre-proline 0 CA--C 1.542 0.643 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 170.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.762 ' HD2' ' SD ' ' A' ' 81' ' ' MET . 52.1 Cg_exo -41.26 1.02 0.0 OUTLIER 'Trans proline' 0 CA--C 1.545 1.033 1 C-N-CA 128.4 6.067 . . . . 0.0 118.92 172.257 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.639 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -38.39 -24.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -162.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.652 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -67.96 -58.88 3.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 119.44 1.018 . . . . 0.0 109.963 173.233 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 89' ' ' LYS . 64.0 pttt -76.62 -12.14 59.97 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.833 -176.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.682 ' HA ' ' HE3' ' A' ' 89' ' ' LYS . 16.8 mt -54.52 -35.23 31.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 173.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.481 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 48.8 t -71.34 -29.11 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.166 0.508 . . . . 0.0 110.319 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.654 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 9.0 tp10 -70.8 -38.5 73.34 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.562 0.696 . . . . 0.0 109.144 174.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 86' ' ' ILE . 9.7 mtmp? -69.09 -20.94 64.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.119 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.496 HD22 HD11 ' A' ' 69' ' ' ILE . 79.9 mt -78.87 -34.18 45.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.958 173.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.658 ' HA ' ' O ' ' A' ' 94' ' ' ASP . 48.7 mtpt -62.91 -27.3 69.28 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.449 176.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -60.02 -29.23 68.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.627 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 7.4 mp -96.4 -50.88 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.086 0.47 . . . . 0.0 110.258 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.658 ' O ' ' HA ' ' A' ' 91' ' ' LYS . 12.5 t70 -134.57 123.5 23.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 178.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.3 m -86.2 -15.28 41.41 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -86.07 -25.66 25.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.707 -0.224 . . . . 0.0 111.171 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.568 HG22 ' O ' ' A' ' 94' ' ' ASP . 14.7 tt -55.47 -31.52 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-O 121.198 0.523 . . . . 0.0 110.89 178.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 91' ' ' LYS . 6.6 t -75.7 -55.73 5.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.364 0.602 . . . . 0.0 109.509 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -91.07 49.48 1.64 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.225 -176.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.66 ' HB3' HG11 ' A' ' 13' ' ' VAL . 0.6 OUTLIER -76.23 -47.85 22.47 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 176.8 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HD2' ' HD3' ' A' ' 104' ' ' LYS . 71.2 mmtt 66.37 143.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.532 0.733 . . . . 0.0 111.687 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.794 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 96.9 m-85 -79.23 41.84 0.47 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.576 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 37.19 48.98 0.82 Allowed 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.881 0.848 . . . . 0.0 110.437 -170.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.732 ' HG3' ' H ' ' A' ' 105' ' ' THR . 0.0 OUTLIER -73.05 -75.58 0.14 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.098 -169.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.732 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 69.2 p . . . . . 0 C--O 1.248 0.977 0 O-C-N 123.991 0.807 . . . . 0.0 111.678 -178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.414 ' HB3' ' H ' ' A' ' 2' ' ' GLU . 24.2 mt-30 . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.667 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 5.6 mp0 -43.26 123.1 2.79 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.673 0.789 . . . . 0.0 111.073 178.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.77 125.39 22.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.095 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 87.35 -79.09 1.8 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.858 -0.687 . . . . 0.0 111.79 -178.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -150.06 -89.22 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.919 -0.658 . . . . 0.0 111.623 179.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.458 ' N ' ' HD3' ' A' ' 7' ' ' PRO . 27.7 mmt85 -143.51 60.47 8.69 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 122.345 0.258 . . . . 0.0 110.482 176.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HD2' ' OD1' ' A' ' 19' ' ' ASN . 4.8 Cg_endo -87.06 49.36 1.94 Allowed 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.925 2.416 . . . . 0.0 111.325 -179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.704 ' HA2' ' HB2' ' A' ' 19' ' ' ASN . . . -75.87 -26.96 63.54 Favored Glycine 0 N--CA 1.448 -0.529 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.33 -177.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.494 ' HA ' ' O ' ' A' ' 84' ' ' MET . . . 177.12 -130.39 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 123.337 0.655 . . . . 0.0 109.421 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -132.81 -47.2 0.87 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.84 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 98' ' ' CYS . 48.2 m -77.69 21.25 0.3 Allowed 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -173.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.664 ' HA ' ' HD2' ' A' ' 15' ' ' LYS . 34.3 tt0 71.4 -67.56 0.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 174.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.745 HG12 HD22 ' A' ' 55' ' ' LEU . 43.8 t -63.28 -55.66 21.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -170.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.782 ' HA ' HD21 ' A' ' 55' ' ' LEU . 20.4 p -64.33 -31.1 72.17 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 12' ' ' GLU . 12.7 ttmt -58.88 -53.9 53.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.019 -0.992 . . . . 0.0 110.5 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.466 ' HB3' ' NH1' ' A' ' 20' ' ' ARG . 50.2 mm-40 -49.68 -54.67 17.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.655 176.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -58.32 -54.4 47.39 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.092 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.799 HD11 ' HB2' ' A' ' 87' ' ' CYS . 96.3 mt -57.44 -53.93 52.61 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -171.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.704 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 0.2 OUTLIER -70.61 -43.36 69.47 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.854 -173.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.577 ' HB3' ' HZ ' ' A' ' 44' ' ' PHE . 46.7 mtp180 -61.33 -41.23 96.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.195 176.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.466 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 41.1 t80 -59.47 -49.25 78.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.968 0.889 . . . . 0.0 109.631 175.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.588 ' OH ' ' HA ' ' A' ' 80' ' ' HIS . 25.7 t80 -58.05 -55.57 33.29 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 113.762 -1.563 . . . . 0.0 111.801 -176.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 24' ' ' SER . 0.5 OUTLIER -67.14 -27.72 67.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.714 0.293 . . . . 0.0 110.997 -176.149 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 23' ' ' LYS . 17.0 t -68.82 -46.13 69.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.632 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -56.85 -52.84 63.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.913 -179.57 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.55 -40.29 88.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.386 -176.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -69.28 -40.24 77.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.033 179.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.8 mtp85 -62.55 -31.53 72.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.965 174.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.3 8.92 40.14 Favored Glycine 0 CA--C 1.502 -0.73 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 174.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.514 HG23 ' N ' ' A' ' 31' ' ' ASN . 5.1 m -89.59 -154.98 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 114.964 -0.618 . . . . 0.0 109.539 179.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 1.106 ' HA ' HD11 ' A' ' 37' ' ' ILE . 22.9 t-20 78.94 91.55 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.747 0.784 . . . . 0.0 112.984 168.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.516 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 17.8 t80 166.45 -30.39 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 113.287 -1.779 . . . . 0.0 107.682 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.493 ' O ' HG12 ' A' ' 37' ' ' ILE . 13.4 m -87.98 117.24 26.71 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.692 175.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.666 HD11 ' HA ' ' A' ' 75' ' ' ARG . 4.1 mm? -63.69 -41.04 98.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.307 -172.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -67.63 -25.89 65.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.351 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 89.7 m -78.97 -43.98 23.36 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.86 178.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 1.106 HD11 ' HA ' ' A' ' 31' ' ' ASN . 47.2 mm -58.61 -31.05 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG3' HD11 ' A' ' 70' ' ' LEU . 28.3 tt0 -57.33 -47.77 80.71 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.563 174.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' HD2' HD12 ' A' ' 42' ' ' ILE . 14.0 mmmm -76.5 -35.2 58.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.921 -178.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' HB3' HD11 ' A' ' 25' ' ' LEU . 23.8 mm-40 -62.18 -40.72 96.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.305 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.411 ' HG ' ' CZ ' ' A' ' 21' ' ' PHE . 19.4 mt -58.9 -33.16 70.21 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.819 HG12 ' H ' ' A' ' 62' ' ' THR . 76.9 mt -74.64 -46.89 40.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.671 178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.9 t -61.89 -47.54 84.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.361 179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 20' ' ' ARG . 32.1 t80 -68.31 -27.88 66.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.364 -178.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 20.3 t -61.08 -28.97 69.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.004 0.43 . . . . 0.0 110.603 174.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -85.98 -42.04 14.35 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 176.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -78.17 49.07 0.79 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.03 0.443 . . . . 0.0 111.512 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.816 ' HB ' ' HB2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -144.34 -173.54 4.05 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.971 178.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -100.69 175.85 5.51 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 121.211 -0.196 . . . . 0.0 110.626 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -47.66 -53.55 12.9 Favored Glycine 0 CA--C 1.522 0.477 0 N-CA-C 114.966 0.747 . . . . 0.0 114.966 -170.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -67.02 -29.56 69.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 117.62 0.71 . . . . 0.0 110.687 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.816 ' HB2' ' HB ' ' A' ' 48' ' ' THR . 71.6 mt-10 -80.63 -36.25 32.88 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.513 -176.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -61.08 -53.33 58.41 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 173.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HD3' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -57.91 -34.64 70.05 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.842 178.061 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.782 HD21 ' HA ' ' A' ' 14' ' ' CYS . 42.7 tp -60.93 -32.69 72.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.43 -175.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 10.3 p -66.94 -21.09 65.99 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.612 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -71.02 -22.96 62.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.127 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.596 ' HB3' HG12 ' A' ' 97' ' ' ILE . 97.3 m-85 -80.47 -35.21 35.16 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.45 -5.53 58.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.844 -179.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 95.17 17.96 35.45 Favored Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.992 170.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.402 ' HB3' ' HB2' ' A' ' 56' ' ' CYS . . . -89.31 -179.29 5.83 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.227 0.513 . . . . 0.0 111.414 -177.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.819 ' H ' HG12 ' A' ' 42' ' ' ILE . 63.2 p 59.6 15.83 4.91 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.531 1.132 . . . . 0.0 113.288 177.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 61.23 -178.94 0.11 Allowed 'General case' 0 C--O 1.236 0.389 0 C-N-CA 122.604 0.362 . . . . 0.0 110.903 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.7 t70 71.74 -47.82 0.67 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.435 0.694 . . . . 0.0 110.974 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.27 155.92 27.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -60.78 112.85 2.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.889 0.376 . . . . 0.0 111.186 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.0 p -64.9 -14.13 58.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.532 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -49.36 -50.92 37.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 58' ' ' TYR . 18.6 tt -80.67 -24.39 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.699 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.565 HD11 ' HG3' ' A' ' 38' ' ' GLU . 3.4 tm? -57.04 -48.47 78.45 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 174.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.607 ' O ' ' HD3' ' A' ' 75' ' ' ARG . 7.8 p -69.56 -35.16 75.14 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.853 177.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -60.46 -32.62 71.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.784 179.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.403 ' O ' ' HD2' ' A' ' 76' ' ' PRO . 96.9 t -85.85 -47.08 16.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.503 178.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.509 ' OG1' ' HA ' ' A' ' 71' ' ' SER . 7.4 p -55.44 -46.76 76.7 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -173.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.666 ' HA ' HD11 ' A' ' 34' ' ' LEU . 3.5 mpt_? -56.38 -56.72 28.75 Favored Pre-proline 0 N--CA 1.469 0.515 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.949 -177.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.52 ' HA ' ' SD ' ' A' ' 81' ' ' MET . 72.4 Cg_endo -75.26 -13.77 20.79 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 121.465 1.444 . . . . 0.0 113.836 -177.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.2 mmt -74.9 -33.22 62.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.067 0.46 . . . . 0.0 109.794 172.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.1 m -68.88 -14.5 63.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.561 -173.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.717 HG13 ' HG3' ' A' ' 81' ' ' MET . 6.5 p -139.53 149.53 22.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.588 ' HA ' ' OH ' ' A' ' 22' ' ' TYR . 2.0 t60 -58.04 105.32 0.26 Allowed 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -177.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.717 ' HG3' HG13 ' A' ' 79' ' ' VAL . 45.7 mtp -141.07 174.24 4.09 Favored Pre-proline 0 CA--C 1.541 0.606 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -169.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.64 ' HD2' ' CB ' ' A' ' 81' ' ' MET . 1.9 Cg_endo -40.83 2.49 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.114 1 C-N-CA 128.301 6.001 . . . . 0.0 118.97 177.305 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.58 ' HA ' HD12 ' A' ' 86' ' ' ILE . . . -35.74 -44.0 0.32 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 116.201 1.926 . . . . 0.0 116.201 -159.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.633 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 0.3 OUTLIER -59.66 -37.62 79.23 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.033 0.833 . . . . 0.0 110.931 177.331 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 38.0 ttpt -84.81 -17.78 37.03 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.978 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 90' ' ' LEU . 44.9 mt -61.8 -41.66 91.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.407 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' CYS . . . . . 0.799 ' HB2' HD11 ' A' ' 18' ' ' LEU . 46.6 t -64.65 -27.43 68.92 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 119.959 -0.696 . . . . 0.0 110.66 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 85' ' ' LYS . 33.7 tt0 -70.06 -31.34 68.9 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.381 0.61 . . . . 0.0 109.57 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 86' ' ' ILE . 53.7 mtmt -78.84 -28.61 44.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.92 174.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 86' ' ' ILE . 88.0 mt -68.4 -23.85 64.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.298 176.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 87' ' ' CYS . 50.6 mtpt -62.1 -25.04 67.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.914 176.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -75.25 -34.25 61.37 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.31 -52.14 36.94 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.387 -0.598 . . . . 0.0 109.387 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.743 ' HB3' HG13 ' A' ' 97' ' ' ILE . 29.2 t0 -160.7 124.61 3.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.263 175.012 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 14.6 m -74.24 -17.96 60.81 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.083 -176.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.4 ' HA ' ' OE1' ' A' ' 96' ' ' GLN . 7.0 tp60 -76.13 -14.04 60.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.081 0.467 . . . . 0.0 110.446 -179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.743 HG13 ' HB3' ' A' ' 94' ' ' ASP . 65.6 mt -67.12 -22.76 29.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.502 -179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.507 ' HB2' ' HB2' ' A' ' 11' ' ' CYS . 14.2 p -117.52 -38.42 3.31 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.492 -176.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -85.11 56.87 4.14 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -173.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.571 ' HB2' HG21 ' A' ' 13' ' ' VAL . 6.1 mp -85.21 -49.37 8.27 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 174.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.449 ' HA ' ' HD3' ' A' ' 101' ' ' LYS . 70.7 mmtt 68.55 130.61 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 O-C-N 124.035 0.834 . . . . 0.0 112.079 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -80.74 68.3 6.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.167 -177.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 72.35 -61.15 0.51 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.416 0.686 . . . . 0.0 111.923 176.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt 57.1 74.07 0.43 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.374 0.607 . . . . 0.0 110.455 -177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.517 -179.748 . . . . . . . . 0 0 . 1 stop_ save_