data_4uet_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 4uet _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 0.538 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 18.4 t80 . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 121.52 0.676 . . . . 2.09 112.221 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -123.27 124.18 42.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.662 -0.699 . . . . 3.54 109.343 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.627 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 56.8 t80 -67.77 -17.61 64.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.276 0.56 . . . . 2.56 110.513 -175.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -82.59 -9.02 59.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.404 -0.816 . . . . 4.16 110.337 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -97.87 -7.63 29.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.074 -0.512 . . . . 2.57 110.799 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 52.5 mt -75.47 135.88 71.95 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.295 -0.632 . . . . 1.31 109.295 177.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.96 112.11 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.658 2.239 . . . . 0.7 111.508 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.4 -22.21 66.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 1.23 112.005 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.76 -30.88 71.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 122.023 0.916 . . . . 1.37 109.533 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.65 ' HE2' ' CE1' ' A' ' 10' ' ' TYR . 88.9 t80 -88.81 -26.25 21.79 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.037 -1.438 . . . . 1.08 110.736 -176.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -72.96 -19.58 61.21 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.681 0.753 . . . . 2.1 109.5 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -72.03 -23.74 61.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.694 -1.139 . . . . 1.02 110.421 172.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.494 HD22 ' CD ' ' A' ' 147' ' ' LYS . 86.8 mt -94.5 17.69 12.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.852 -0.613 . . . . 1.49 112.046 -175.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.442 ' SD ' ' HG2' ' A' ' 19' ' ' ARG . 19.4 ptp -128.08 145.16 54.29 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 120.795 -0.362 . . . . 1.65 110.046 177.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.456 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 31.9 Cg_exo -59.65 140.33 93.11 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.986 2.457 . . . . 1.12 112.316 -176.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.88 -34.18 90.84 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.964 3.11 . . . . 1.3 112.692 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.56 -39.38 93.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.619 -0.718 . . . . 2.26 110.366 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.22 -4.41 50.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 1.39 110.755 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 31.7 mtm180 -98.45 -38.77 9.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.986 -0.552 . . . . 2.54 110.162 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -48.78 -42.74 36.74 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.899 0.75 . . . . 1.06 111.275 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.663 ' HE1' ' CE2' ' A' ' 21' ' ' PHE . 61.5 t80 -56.76 -54.84 41.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.533 -0.758 . . . . 0.73 112.132 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.598 HD23 ' OH ' ' A' ' 100' ' ' TYR . 65.5 mt -79.53 -10.71 59.85 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.203 0.91 . . . . 1.75 111.266 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.26 -45.72 75.83 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.125 0.488 . . . . 2.56 110.795 162.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -88.81 -26.48 21.67 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.752 0.649 . . . . 1.84 112.752 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.484 HD22 ' CD2' ' A' ' 22' ' ' LEU . 4.8 tp -77.11 136.59 38.63 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-O 121.209 0.528 . . . . 1.7 110.431 -174.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.429 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 4.9 p -120.55 -179.18 3.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.525 -0.761 . . . . 2.16 111.738 -171.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.45 -52.17 48.62 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 2.39 112.955 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.87 -42.05 78.21 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 116.226 -0.443 . . . . 1.47 113.31 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.42 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.8 m-20 -80.86 -36.16 31.75 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.795 -0.238 . . . . 2.25 111.169 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 26' ' ' SER . 96.8 mttt -55.86 -34.03 65.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.325 0.583 . . . . 1.89 110.448 177.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.7 m -55.53 -36.56 66.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.01 -0.996 . . . . 1.37 112.145 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.0 p -88.34 -21.47 6.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 111.978 0.362 . . . . 0.85 111.978 -171.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.419 HD21 ' HA ' ' A' ' 30' ' ' LYS . 4.2 mm? -52.99 -48.06 67.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.681 0.277 . . . . 1.65 111.193 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -64.22 -27.68 69.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.338 -0.392 . . . . 2.89 111.184 -175.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -68.52 -37.21 79.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.047 0.451 . . . . 1.96 110.052 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 93.4 t -72.62 -48.97 44.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.71 -0.677 . . . . 0.98 110.104 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.64 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 32.3 m-85 -57.0 -52.67 64.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.462 1.282 . . . . 1.08 114.462 176.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.63 -20.4 59.92 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.286 -0.566 . . . . 2.71 111.574 -171.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.64 -74.93 0.21 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.484 -0.325 . . . . 1.57 110.255 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.469 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.89 -157.16 1.19 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 121.017 -0.611 . . . . 1.54 112.968 -176.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -95.95 153.58 10.61 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 CA-C-N 118.536 1.168 . . . . 1.99 112.001 -7.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.469 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 27.7 m-85 -122.3 120.69 34.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 1.72 111.137 -171.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.61 -8.16 54.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.149 -0.932 . . . . 4.11 110.554 175.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -160.19 163.81 33.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.018 -0.734 . . . . 1.53 109.018 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.3 m -77.8 -22.77 49.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.776 -0.193 . . . . 1.72 111.509 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.83 -36.0 77.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 2.24 110.421 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 14.6 mm-40 -57.71 -40.85 80.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.136 0.493 . . . . 2.26 110.787 173.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.3 t -70.97 -36.05 72.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.772 -0.649 . . . . 1.69 109.846 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.76 -44.87 98.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.286 0.565 . . . . 1.2 109.745 176.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.56 -48.7 80.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.021 -0.991 . . . . 1.29 111.159 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.55 -40.65 87.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.324 0.583 . . . . 1.21 110.273 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.65 -38.24 83.52 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.307 -0.861 . . . . 1.13 111.057 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -31.11 72.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.086 0.469 . . . . 1.87 110.995 177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -75.15 -46.8 31.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 3.57 110.946 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -82.79 -37.41 24.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.178 -0.465 . . . . 2.01 112.237 -175.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.7 t -144.49 87.95 7.42 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 109.472 -0.566 . . . . 1.68 109.472 176.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -41.42 -60.55 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 124.201 3.268 . . . . 0.84 113.9 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.55 -34.53 74.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.117 -0.947 . . . . 2.45 111.969 -178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.94 -36.81 78.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.061 -0.718 . . . . 2.03 109.061 -175.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.51 -35.34 91.92 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 114.664 -1.153 . . . . 0.41 111.668 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.99 -35.8 69.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.116 0.484 . . . . 1.19 110.384 175.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -64.2 -44.26 92.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 2.7 111.08 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.5 m -74.71 -30.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.944 -0.302 . . . . 1.12 110.765 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.67 -58.89 6.6 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.256 -0.429 . . . . 1.7 110.77 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.506 ' O ' ' HG3' ' A' ' 69' ' ' MET . 82.7 tttt -57.49 -37.49 73.02 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.476 0.655 . . . . 4.35 110.254 -176.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.498 ' HA ' ' HE3' ' A' ' 69' ' ' MET . 3.4 tm? -65.89 -45.69 81.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.02 -0.991 . . . . 2.09 109.958 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -78.3 -30.75 48.52 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.113 -0.699 . . . . 3.07 109.113 -172.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.78 -45.51 94.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.155 -0.929 . . . . 1.26 111.534 176.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.506 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 53.1 mtm -59.61 -48.36 81.95 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.381 0.61 . . . . 1.21 109.873 176.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.4 t -54.88 -45.53 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 114.915 -1.039 . . . . 0.79 110.611 177.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -63.61 -38.12 89.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 2.03 111.663 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.0 m -61.03 -37.48 82.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.082 0.468 . . . . 1.66 110.791 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.0 mttm -73.47 -48.17 35.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.833 -0.621 . . . . 2.14 110.003 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.501 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 81.1 mt -62.08 -20.62 24.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.665 0.745 . . . . 1.1 110.678 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.41 -27.81 61.66 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.394 -0.821 . . . . 1.18 109.793 177.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.35 0.79 57.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.402 -1.272 . . . . 1.11 110.279 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 132' ' ' PHE . 7.6 tp -96.02 140.34 30.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.726 -0.67 . . . . 1.34 110.634 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.86 160.21 53.18 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.998 -0.62 . . . . 0.76 112.158 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -48.04 -42.96 31.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.929 3.086 . . . . 1.89 113.657 -174.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.13 -45.19 74.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.601 -0.272 . . . . 2.52 110.966 -177.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.87 -30.83 40.35 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.002 -0.679 . . . . 1.13 110.297 -176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.501 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 41.1 ttmt -62.78 -40.72 98.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.625 -0.716 . . . . 2.52 110.704 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.5 -36.93 93.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.878 -0.677 . . . . 0.46 111.869 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -68.55 -46.5 69.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.192 . . . . 2.04 110.545 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.78 -55.24 36.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.74 0.305 . . . . 1.07 111.547 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -84.26 39.46 0.72 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 1.96 110.691 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.409 ' HD3' HD22 ' A' ' 120' ' ' LEU . 61.1 tttp -149.51 -43.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.681 -0.69 . . . . 2.74 109.285 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.7 p -67.31 -44.2 79.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.335 -0.393 . . . . 0.65 110.156 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 61.0 mt -64.06 -32.97 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-N 116.109 -0.496 . . . . 1.79 110.183 176.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -60.79 -35.72 77.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.968 0.413 . . . . 2.82 110.069 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.1 mt -72.22 -50.59 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 1.2 110.027 176.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.84 99.77 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.862 -0.608 . . . . 1.23 111.484 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.03 -37.08 84.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.749 -0.659 . . . . 5.02 110.006 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.38 -31.9 81.01 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 121.096 -0.573 . . . . 0.72 111.916 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.412 HD12 ' HB2' ' A' ' 113' ' ' SER . 30.8 mm -62.99 -53.54 45.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 1.23 110.667 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.44 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 55.7 pttt -84.36 3.44 35.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.204 -0.453 . . . . 3.16 110.904 -178.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.64 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -91.5 -34.56 14.74 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.779 -0.452 . . . . 1.33 109.779 170.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.481 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 7.3 ptp180 -83.68 -3.59 57.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.261 -0.644 . . . . 3.64 109.261 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.538 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.2 m-85 -79.33 -34.42 42.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.709 -0.478 . . . . 1.28 109.709 164.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.634 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 22.9 m-85 -67.62 -44.92 76.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.373 0.606 . . . . 1.78 110.642 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.479 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.6 p -66.22 -21.93 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.078 -0.964 . . . . 1.51 112.675 -174.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.75 1.03 56.36 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.871 -0.681 . . . . 1.16 112.067 -174.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -93.6 56.88 2.46 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.878 0.37 . . . . 2.22 110.02 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -55.7 119.36 24.76 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.495 -0.775 . . . . 1.75 111.98 -172.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.481 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 36.8 Cg_endo -67.38 146.81 76.28 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.409 2.739 . . . . 0.71 112.543 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -77.32 168.27 20.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.777 -0.453 . . . . 2.17 109.777 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -56.77 -32.65 65.84 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.473 0.654 . . . . 3.31 111.163 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -83.28 -14.57 52.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.561 -0.745 . . . . 2.24 111.468 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.447 ' HB3' ' HB2' ' A' ' 105' ' ' PRO . 12.2 t70 -68.04 -40.96 82.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.608 -0.515 . . . . 1.73 109.608 174.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -30.75 71.77 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.554 -0.748 . . . . 1.56 110.985 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -59.75 -46.55 88.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.607 -0.516 . . . . 2.31 109.607 176.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.067 -0.97 . . . . 1.19 110.821 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.412 ' HB2' HD12 ' A' ' 95' ' ' ILE . 33.5 t -53.38 -60.54 3.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 1.84 111.478 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 16.2 m -76.19 -24.02 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.014 0.435 . . . . 0.66 110.824 -172.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -54.94 -45.57 74.86 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.865 -0.607 . . . . 2.26 110.758 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.496 ' O ' HD11 ' A' ' 120' ' ' LEU . 31.7 mt-10 -75.03 -31.99 61.48 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.313 -0.555 . . . . 2.27 111.108 -178.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.3 m -65.29 -32.67 59.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 119.647 -0.821 . . . . 0.91 109.92 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.458 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 83.0 mt -75.35 -36.4 61.0 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.416 . . . . 1.75 109.878 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.13 -38.09 82.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.467 0.651 . . . . 1.51 109.486 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.496 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -78.7 -44.51 23.41 Favored 'General case' 0 N--CA 1.438 -1.025 0 CA-C-N 115.136 -0.938 . . . . 1.68 112.073 174.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.656 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 16.4 t80 -72.91 -32.44 65.33 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 119.476 -0.89 . . . . 2.2 111.759 -169.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -66.78 -32.73 74.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.084 0.469 . . . . 2.44 110.632 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.85 -9.52 59.28 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.775 0.657 . . . . 1.16 112.775 -174.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.0 mtm -75.07 154.7 37.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.317 -0.553 . . . . 1.15 110.608 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.3 m -64.4 143.72 57.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.11 -0.33 . . . . 1.57 110.11 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.68 -45.93 63.63 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.317 0.488 . . . . 2.21 112.317 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.97 -33.34 73.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.89 0.376 . . . . 1.18 111.032 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -75.03 -35.24 50.33 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.536 -0.626 . . . . 0.35 111.536 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.65 -43.13 94.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.197 0.522 . . . . 1.84 109.617 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.57 -29.86 66.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.53 -0.759 . . . . 1.15 111.467 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -75.19 -30.62 60.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.071 0.462 . . . . 0.55 109.803 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.425 ' HA ' HD12 ' A' ' 77' ' ' LEU . 90.8 t80 -61.65 -27.21 68.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.604 . . . . 0.49 110.162 172.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.82 -3.35 73.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.942 -0.646 . . . . 0.27 113.052 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -96.54 -39.94 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.481 0.657 . . . . 2.95 109.915 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -86.39 -32.42 20.94 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.884 -1.053 . . . . 1.83 110.634 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.667 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 53.1 m-85 -136.24 73.1 58.23 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.994 0.426 . . . . 0.91 110.951 174.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.99 -36.72 81.41 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.287 2.658 . . . . 1.06 112.942 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.65 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 38.2 t80 -61.71 -40.08 93.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.508 -0.314 . . . . 2.9 110.878 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -77.37 -43.22 33.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 1.67 110.604 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.07 -40.07 73.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 1.04 109.947 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.497 ' HE3' ' HA ' ' A' ' 141' ' ' LYS . 0.0 OUTLIER -44.95 -68.06 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.955 -1.02 . . . . 3.06 111.613 173.449 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.0 OUTLIER -65.0 -22.77 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.229 -0.896 . . . . 0.5 112.132 -174.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -78.99 -38.92 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.191 -0.604 . . . . 0.92 110.739 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 49.6 mt-10 -71.09 -43.85 66.88 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.908 0.385 . . . . 2.58 110.316 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.0 m -69.78 -20.0 63.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.742 -0.663 . . . . 1.81 111.059 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 86.07 15.34 65.09 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.767 -0.73 . . . . 1.41 112.583 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.494 ' CD ' HD22 ' A' ' 13' ' ' LEU . 0.7 OUTLIER -63.02 -42.92 99.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.491 -0.559 . . . . 2.46 109.491 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -69.93 -32.75 71.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 1.07 110.298 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.458 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -60.84 -41.67 96.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.839 -0.618 . . . . 1.12 111.052 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -71.38 -8.97 57.26 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.842 0.353 . . . . 3.27 111.512 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.662 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 32.7 t80 -93.99 -40.53 10.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.945 0.402 . . . . 0.68 109.953 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -77.18 -24.59 51.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.823 -0.626 . . . . 1.18 112.362 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.714 0 N-CA-C 110.012 -1.235 . . . . 1.62 110.012 -169.478 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 9.3 p90 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.364 0.602 . . . . 2.09 111.705 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 71.8 mmtt -111.14 171.88 7.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.712 -0.676 . . . . 3.54 109.369 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.66 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 75.7 t80 -61.81 -50.44 72.28 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.153 0.502 . . . . 2.56 109.971 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -74.3 -6.43 47.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 4.16 111.883 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -78.88 -29.61 44.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.294 -0.632 . . . . 2.57 109.294 -177.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.8 mt -69.31 135.6 88.9 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.625 -0.716 . . . . 1.31 109.093 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -45.46 119.72 2.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.259 2.639 . . . . 0.7 112.28 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.24 -18.66 65.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 1.23 112.123 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.68 -33.72 75.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.984 0.897 . . . . 1.37 109.251 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.665 ' HE2' ' CE1' ' A' ' 10' ' ' TYR . 52.8 t80 -82.61 -29.32 30.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 113.99 -1.459 . . . . 1.08 111.26 -176.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.416 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 18.5 mtm180 -71.98 -18.08 62.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.455 0.645 . . . . 2.1 109.483 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.61 -27.24 63.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.727 -1.124 . . . . 1.02 110.634 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.453 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 71.8 mt -77.26 -51.54 10.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.976 -0.557 . . . . 1.49 111.385 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.419 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 25.3 ptt? -75.3 136.9 71.83 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 1.65 111.515 -174.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 31.7 Cg_exo -59.68 159.8 23.16 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.534 2.823 . . . . 1.12 112.957 -177.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -53.34 -31.41 56.87 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.55 2.833 . . . . 1.3 112.952 -178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.488 ' O ' HD22 ' A' ' 66' ' ' LEU . 43.8 mt-10 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.816 0.341 . . . . 2.26 110.564 177.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -21.32 66.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.319 -0.401 . . . . 1.39 111.187 -178.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.748 ' HB3' ' HH ' ' A' ' 3' ' ' TYR . 20.0 mtm180 -88.39 -31.18 18.98 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.955 -0.566 . . . . 2.54 110.715 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -52.15 -51.23 59.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.99 -0.55 . . . . 1.06 111.262 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.633 ' HE1' ' CE2' ' A' ' 21' ' ' PHE . 66.6 t80 -55.41 -61.56 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.73 111.627 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 59.9 mt -74.46 -9.19 58.35 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 119.108 0.867 . . . . 1.75 111.944 -176.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.35 -40.24 77.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.192 0.52 . . . . 2.56 109.989 163.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.88 -47.11 40.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.446 -0.797 . . . . 1.84 111.074 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.595 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.9 mm? -59.85 141.54 55.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.4 0.619 . . . . 1.7 111.202 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.6 t -116.14 -63.76 1.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.431 -0.804 . . . . 2.16 110.314 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -176.02 -47.83 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.134 0.271 . . . . 2.39 111.432 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.61 -34.64 79.1 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.519 -0.848 . . . . 1.47 111.305 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -36.93 69.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 2.25 109.946 173.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 88.5 mttt -61.64 -26.88 68.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.329 -0.85 . . . . 1.89 111.61 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.7 m -64.64 -35.67 81.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 1.37 110.35 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.6 t -66.27 -41.03 88.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.85 110.715 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.564 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.4 mm? -56.77 -46.27 81.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.915 0.388 . . . . 1.65 110.417 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -55.88 -43.21 76.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 2.89 111.681 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -69.86 -33.2 71.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 1.96 111.407 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.467 ' CG1' ' HH ' ' A' ' 42' ' ' TYR . 67.6 t -75.59 -51.27 21.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.98 110.8 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.403 ' HB3' ' CG2' ' A' ' 101' ' ' THR . 14.6 m-85 -48.14 -50.61 28.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.791 1.034 . . . . 1.08 113.791 174.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -73.73 -25.55 60.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.115 -0.634 . . . . 2.71 111.571 -175.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.56 -79.16 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.17 -0.308 . . . . 1.57 110.17 174.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.531 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.43 -148.23 3.41 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.749 -0.739 . . . . 1.54 112.395 -173.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.5 149.82 12.9 Favored 'Cis proline' 0 N--CA 1.454 -0.813 0 CA-C-N 118.734 1.267 . . . . 1.99 111.116 -8.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.531 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 18.0 m-85 -118.44 128.12 54.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.485 0.659 . . . . 1.72 111.62 -170.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.445 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -86.89 -15.15 39.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.67 -1.15 . . . . 4.11 108.314 175.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -150.71 150.52 31.16 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.079 -1.082 . . . . 1.53 108.079 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.549 HG22 ' NE2' ' A' ' 67' ' ' HIS . 4.7 m -77.04 -16.12 59.38 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.87 -0.332 . . . . 1.72 111.694 -171.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -62.45 -26.88 68.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 2.24 110.21 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.7 mt-10 -65.09 -41.37 95.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 2.26 110.583 173.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 41.2 t -69.17 -41.46 77.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.143 0.496 . . . . 1.69 110.046 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 98.0 mt -61.01 -44.33 97.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.674 -0.694 . . . . 1.2 110.057 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -51.42 69.54 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 1.29 111.661 174.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -56.93 -43.16 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 1.21 110.718 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.411 HD22 HD11 ' A' ' 33' ' ' LEU . 45.9 mt -68.36 -34.03 75.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.298 -0.864 . . . . 1.13 111.241 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.09 -28.52 68.25 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.739 0.304 . . . . 1.87 111.222 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -76.52 -45.13 32.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.035 0.445 . . . . 3.57 110.739 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 31.1 mmmt -67.27 -46.77 72.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.865 -0.607 . . . . 2.01 111.149 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.417 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 22.9 t -149.5 102.18 3.29 Favored Pre-proline 0 C--N 1.315 -0.919 0 C-N-CA 120.818 -0.353 . . . . 1.68 110.327 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 4.4 Cg_endo -47.09 -59.62 1.18 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 123.581 2.854 . . . . 0.84 113.346 -168.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.16 -28.04 66.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.578 -0.737 . . . . 2.45 111.283 -177.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -40.36 81.47 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.241 -1.022 . . . . 2.03 108.241 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.81 -23.08 65.08 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.365 -1.289 . . . . 0.41 112.156 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.72 -31.1 66.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.867 0.365 . . . . 1.19 110.733 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.63 -47.23 76.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.289 -0.414 . . . . 2.7 110.539 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.39 -29.0 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 1.12 110.736 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 4.9 tm-20 -60.79 -55.17 36.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.692 -0.686 . . . . 1.7 110.239 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.5 ptmm? -62.52 -30.28 71.17 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-O 121.148 0.499 . . . . 4.35 109.911 -176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.495 ' HG ' ' HB2' ' A' ' 21' ' ' PHE . 0.2 OUTLIER -72.49 -1.45 15.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.514 -0.766 . . . . 2.09 111.274 -176.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.629 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 67.5 m80 -118.88 -46.79 2.53 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.241 -0.436 . . . . 3.07 110.821 175.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.42 -43.41 83.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.612 0.227 . . . . 1.26 111.612 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 33.8 mtm -61.2 -41.34 96.66 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.474 0.654 . . . . 1.21 110.237 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.0 t -71.39 -40.41 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.211 -0.904 . . . . 0.79 110.76 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 30.4 mmmt -60.55 -34.93 74.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.735 -0.666 . . . . 2.03 111.018 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.3 m -60.2 -33.0 71.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.289 0.566 . . . . 1.66 111.135 177.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.2 mttp -82.24 -42.59 18.7 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.562 -0.744 . . . . 2.14 110.194 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -69.6 -24.07 26.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.213 0.53 . . . . 1.1 111.055 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.0 -26.82 64.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.945 0.879 . . . . 1.18 109.558 174.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.34 2.5 55.82 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.32 -1.309 . . . . 1.11 110.101 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' A' ' 132' ' ' PHE . 12.1 tp -96.44 136.35 37.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.533 -0.758 . . . . 1.34 109.958 -175.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.5 153.05 51.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.592 -0.813 . . . . 0.76 112.32 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -42.53 -41.31 7.91 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 124.558 3.505 . . . . 1.89 113.518 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -64.01 -49.52 72.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.948 -0.569 . . . . 2.52 110.787 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.535 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.05 -31.91 34.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.904 -0.589 . . . . 1.13 110.664 -176.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -56.02 -48.03 76.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 2.52 110.881 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.04 -40.0 94.99 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.819 -0.705 . . . . 0.46 111.917 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.444 ' CE2' ' HB2' ' A' ' 121' ' ' TYR . 4.9 t80 -69.37 -44.23 71.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.74 -0.23 . . . . 2.04 111.08 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.38 -49.72 76.24 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.089 0.471 . . . . 1.07 111.047 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -67.32 -14.23 62.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.611 -0.722 . . . . 1.96 111.058 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -94.53 -46.5 6.95 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.476 -0.329 . . . . 2.74 110.691 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 p -65.25 -34.22 77.83 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.321 -0.4 . . . . 0.65 110.728 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.413 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 17.7 mt -55.77 -46.05 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 115.979 -0.555 . . . . 1.79 110.745 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.775 0.322 . . . . 2.82 110.989 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.63 -51.81 47.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 1.2 110.351 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.12 68.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 1.23 110.934 -178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.475 ' NH2' HD13 ' A' ' 66' ' ' LEU . 4.4 mpt_? -69.7 -32.79 71.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.938 -0.574 . . . . 5.02 110.28 173.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -65.61 -38.73 94.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.155 -0.545 . . . . 0.72 112.081 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.411 HD12 ' CB ' ' A' ' 113' ' ' SER . 38.9 mm -56.64 -51.04 71.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.26 0.552 . . . . 1.23 110.129 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.2 mppt? -93.8 28.64 2.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.807 -0.633 . . . . 3.16 110.181 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -108.1 -33.66 7.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.457 -0.942 . . . . 1.33 108.457 164.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.505 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 5.2 ptp180 -86.17 -9.65 56.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.543 -0.753 . . . . 3.64 109.995 175.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.463 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 12.9 m-85 -77.38 -29.97 53.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.112 -0.699 . . . . 1.28 109.112 163.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.659 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 2.5 m-85 -83.94 -52.77 6.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.515 -0.766 . . . . 1.78 111.994 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.505 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 10.5 p -59.12 -26.3 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.299 0.852 . . . . 1.51 113.299 -173.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 108.89 39.31 1.73 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.699 -0.762 . . . . 1.16 113.608 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.501 ' OD1' ' HB2' ' A' ' 98' ' ' ARG . 4.5 p30 -149.08 68.8 1.05 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.33 0.586 . . . . 2.22 109.995 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -45.12 125.89 5.53 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 114.834 -1.075 . . . . 1.75 111.944 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.473 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 58.1 Cg_endo -74.19 155.35 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.989 2.459 . . . . 0.71 111.937 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 171.63 8.96 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.145 -0.687 . . . . 2.17 109.145 173.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -62.01 -29.8 70.51 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.388 -0.525 . . . . 3.31 110.646 -176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.36 -31.31 72.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.879 -0.6 . . . . 2.24 110.863 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.99 -46.81 70.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.375 -0.375 . . . . 1.73 110.292 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.81 -43.1 97.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 1.56 110.031 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 151' ' ' PHE . 41.8 tttp -52.6 -53.29 48.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.651 -0.704 . . . . 2.31 110.528 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.445 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -62.65 -39.25 93.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.284 -0.871 . . . . 1.19 111.592 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.411 ' CB ' HD12 ' A' ' 95' ' ' ILE . 49.4 m -67.48 -44.5 78.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.841 0.682 . . . . 1.84 112.841 -178.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 2.9 m -71.27 -28.38 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 N-CA-C 108.607 -0.886 . . . . 0.66 108.607 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 84.4 tttt -53.62 -39.17 64.71 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.295 . . . . 2.26 111.25 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.591 ' O ' HD11 ' A' ' 120' ' ' LEU . 25.3 mt-10 -73.72 -36.82 65.24 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 120.113 -0.635 . . . . 2.27 111.322 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.8 m -64.77 -31.92 55.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 C-N-CA 119.98 -0.688 . . . . 0.91 110.459 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 6.8 mp -80.05 -31.76 39.45 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.768 -0.583 . . . . 1.75 110.483 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -55.12 -42.7 73.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.852 0.834 . . . . 1.51 109.369 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.591 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -77.37 -47.02 20.97 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.45 -1.25 . . . . 1.68 112.11 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.656 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 20.6 t80 -70.33 -33.75 71.85 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 119.61 -0.836 . . . . 2.2 111.775 -170.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -66.82 -30.6 70.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 2.44 111.174 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -84.84 -7.27 59.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.756 -0.656 . . . . 1.16 112.604 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.535 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 58.7 mtm -74.53 158.44 33.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.506 -0.478 . . . . 1.15 110.951 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 7.3 m -65.07 145.72 55.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.45 -0.341 . . . . 1.57 110.282 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.75 -47.25 70.84 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.01 0.374 . . . . 2.21 112.01 -173.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.86 -27.46 69.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 1.18 110.992 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.48 -34.22 29.29 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.743 -0.543 . . . . 0.35 111.743 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -66.78 -45.04 79.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 1.84 109.98 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 134' ' ' LYS . . . -68.7 -26.44 65.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.367 -0.833 . . . . 1.15 110.691 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.443 ' OD2' HD13 ' A' ' 77' ' ' LEU . 24.6 t70 -78.28 -29.28 47.87 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.209 -0.663 . . . . 0.55 109.209 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.459 ' HA ' HD12 ' A' ' 77' ' ' LEU . 84.2 t80 -66.4 -34.05 77.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 0.49 110.189 173.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.31 -13.96 65.79 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.933 -0.651 . . . . 0.27 112.704 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 130' ' ' ALA . 58.2 mttm -91.17 -16.69 27.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.224 0.535 . . . . 2.95 110.529 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.412 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 57.2 mm-40 -110.87 -35.92 5.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.617 -0.72 . . . . 1.83 110.27 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -122.68 76.41 47.01 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.589 -0.523 . . . . 0.91 109.589 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.14 -30.32 46.86 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.828 2.352 . . . . 1.06 113.074 -172.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.663 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 11.9 m-85 -77.76 -36.06 51.07 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.186 0.439 . . . . 2.9 112.186 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.403 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.3 mt -71.81 -47.53 52.67 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 119.904 -0.718 . . . . 1.67 109.716 177.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.42 72.63 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.054 0.454 . . . . 1.04 110.051 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 84.1 tttt -50.25 -73.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.272 -0.876 . . . . 3.06 111.19 171.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.7 m -65.39 -25.54 37.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.336 -0.847 . . . . 0.5 112.667 -172.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.403 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 20.0 m-30 -69.5 -50.79 41.89 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.557 -0.457 . . . . 0.92 110.606 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.7 -28.75 64.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 2.58 111.425 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.1 m -76.56 -9.45 58.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.02 0.438 . . . . 1.81 110.729 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 78.56 17.65 77.21 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 121.128 -0.558 . . . . 1.41 112.621 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.453 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 0.8 OUTLIER -74.27 -51.73 14.43 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.407 -0.59 . . . . 2.46 109.407 -178.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.6 -33.85 76.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.132 0.492 . . . . 1.07 110.166 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -60.58 -35.6 76.47 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.537 -0.756 . . . . 1.12 110.781 176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -73.23 -34.65 66.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.046 0.45 . . . . 3.27 110.483 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.467 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 38.1 t80 -63.56 -45.11 92.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 0.68 109.705 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -75.07 -22.24 58.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.858 -0.61 . . . . 1.18 111.519 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 110.282 -1.127 . . . . 1.62 110.282 -175.208 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 0.697 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 67.8 t80 . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.828 0.347 . . . . 2.09 110.908 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.438 ' C ' ' HZ2' ' A' ' 30' ' ' LYS . 28.8 mtmm -120.86 -83.15 0.66 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.283 -0.417 . . . . 3.54 111.018 174.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.639 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 47.4 t80 167.25 -42.74 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.669 -0.863 . . . . 2.56 108.669 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.449 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 52.7 mt-10 -66.49 -18.88 65.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.932 -1.031 . . . . 4.16 110.685 175.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.75 -5.34 57.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.522 . . . . 2.57 111.193 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mt -80.84 137.16 50.53 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 108.702 -0.851 . . . . 1.31 108.702 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -46.9 115.39 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.709 2.272 . . . . 0.7 111.716 176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.86 -20.55 65.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.043 -0.526 . . . . 1.23 111.209 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.03 -35.92 82.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.648 0.737 . . . . 1.37 110.097 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.599 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 77.7 t80 -83.66 -29.16 27.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.688 -1.142 . . . . 1.08 111.414 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.449 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 20.9 mtm180 -69.23 -20.85 63.96 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.508 0.671 . . . . 2.1 109.427 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -68.16 -15.14 63.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.597 -1.183 . . . . 1.02 110.473 175.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.3 mt -104.27 -0.46 28.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 1.49 110.827 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.5 mtt -81.67 130.32 61.82 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.605 -0.271 . . . . 1.65 111.281 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -56.43 138.59 84.65 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.731 2.287 . . . . 1.12 111.505 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.26 -29.37 90.15 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.53 2.82 . . . . 1.3 112.79 -173.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -70.48 -49.08 52.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.233 -0.44 . . . . 2.26 110.083 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.9 71.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.39 110.956 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -67.87 -40.64 83.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 2.54 111.022 177.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -52.88 -46.03 67.76 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.397 0.436 . . . . 1.06 111.278 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.647 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 30.9 t80 -57.74 -61.0 2.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 0.73 111.265 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.474 HD13 ' HH ' ' A' ' 100' ' ' TYR . 8.2 mp -72.69 -8.25 54.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.994 0.816 . . . . 1.75 112.261 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -70.68 -57.35 4.78 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.852 0.358 . . . . 2.56 110.986 163.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.22 -37.07 33.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.036 -0.529 . . . . 1.84 111.905 -171.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.699 ' CD1' ' HB2' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -63.89 137.19 57.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 109.653 -0.499 . . . . 1.7 109.653 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.7 p -123.95 179.37 4.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.456 -0.338 . . . . 2.16 111.77 -170.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -56.45 -41.06 75.86 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.845 0.683 . . . . 2.39 112.845 -171.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.16 -34.06 82.49 Favored Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.727 -0.749 . . . . 1.47 112.481 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.699 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -85.0 -33.82 22.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.979 0.419 . . . . 2.25 109.887 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HZ2' ' C ' ' A' ' 2' ' ' LYS . 87.0 mttt -66.98 -10.8 53.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.557 0.694 . . . . 1.89 109.99 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 90.6 m -74.2 -31.94 62.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.871 -1.059 . . . . 1.37 110.486 174.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.636 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 10.2 p -87.14 -28.82 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 120.671 -0.411 . . . . 0.85 110.913 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.406 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.3 mm? -52.19 -48.7 64.89 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.348 0.118 . . . . 1.65 111.182 174.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -63.84 -34.18 77.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.767 0.318 . . . . 2.89 111.438 -178.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -68.9 -39.61 79.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.375 -0.375 . . . . 1.96 110.84 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.98 -43.81 38.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-O 121.177 0.513 . . . . 0.98 111.103 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.596 ' HE2' ' CE1' ' A' ' 37' ' ' PHE . 20.0 m-85 -60.2 -33.74 72.66 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 113.661 0.986 . . . . 1.08 113.661 174.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -92.52 9.39 34.71 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.656 -0.818 . . . . 2.71 110.547 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -101.97 -78.9 0.53 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.334 -0.848 . . . . 1.57 108.887 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.533 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.59 -151.35 3.03 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.85 -0.691 . . . . 1.54 112.808 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.409 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.29 130.92 5.83 Favored 'Cis proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.163 -1.182 . . . . 1.99 110.916 -9.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.533 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 19.5 m-85 -105.55 120.29 41.27 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.438 -0.801 . . . . 1.72 111.31 -170.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -73.14 -16.86 61.44 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.089 -0.96 . . . . 4.11 110.212 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.424 HD22 ' HG3' ' A' ' 47' ' ' GLU . 6.9 p30 -144.39 174.54 10.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.233 -0.439 . . . . 1.53 110.17 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.7 m -75.89 -37.05 59.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 1.72 111.165 -177.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -60.16 -35.24 74.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.023 -0.535 . . . . 2.24 112.321 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.447 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.8 mt-10 -61.28 -36.63 80.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.895 0.378 . . . . 2.26 110.985 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 30.0 t -74.34 -34.91 63.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.853 -0.425 . . . . 1.69 109.853 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.6 mt -62.92 -42.26 95.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.561 0.696 . . . . 1.2 109.6 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.85 76.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.667 -1.151 . . . . 1.29 111.802 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.05 79.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.087 -0.506 . . . . 1.21 110.896 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.99 -40.32 83.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 1.13 110.855 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -62.38 -34.71 77.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.692 0.282 . . . . 1.87 111.657 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -66.23 -44.48 83.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.437 . . . . 3.57 110.84 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.636 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 8.5 tppt? -77.11 -56.32 4.67 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.937 0.398 . . . . 2.01 110.543 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 m -125.34 103.99 28.9 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-O 121.51 0.671 . . . . 1.68 109.992 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.63 -56.21 1.63 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.635 2.89 . . . . 0.84 113.361 -170.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.501 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 48.6 mm-40 -73.88 -24.27 59.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.802 -0.636 . . . . 2.45 111.084 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.555 ' HG ' ' HB3' ' A' ' 29' ' ' ASP . 0.9 OUTLIER -71.05 -42.92 68.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.813 -0.81 . . . . 2.03 108.813 -178.078 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.62 -24.36 76.95 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.392 -1.276 . . . . 0.41 111.619 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.02 74.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.809 0.337 . . . . 1.19 110.82 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 66.9 mttm -60.56 -54.7 42.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.956 -0.565 . . . . 2.7 110.72 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.78 -30.21 49.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 1.12 110.958 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -61.36 -60.37 3.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.279 -0.419 . . . . 1.7 111.164 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 69' ' ' MET . 91.5 mttt -62.52 -33.2 74.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 4.35 110.345 -176.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 21' ' ' PHE . 34.2 tp -64.9 -41.3 95.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.352 -0.84 . . . . 2.09 110.602 176.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -72.66 -32.09 65.59 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.955 -0.757 . . . . 3.07 108.955 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.53 -36.02 76.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.409 -1.269 . . . . 1.26 111.526 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 44.2 mtm -65.59 -51.28 60.93 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.262 0.553 . . . . 1.21 110.137 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.47 -39.68 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.312 -0.858 . . . . 0.79 110.094 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tpmt? -60.06 -40.39 89.3 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.615 -0.721 . . . . 2.03 110.439 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -61.64 -38.13 86.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.05 0.452 . . . . 1.66 110.685 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -75.55 -47.19 27.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.052 -0.522 . . . . 2.14 110.341 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.2 mt -63.2 -20.96 27.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.586 0.708 . . . . 1.1 110.388 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.29 -30.73 63.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.2 -0.909 . . . . 1.18 110.005 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.1 -3.2 58.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.44 -1.254 . . . . 1.11 110.008 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.95 130.54 37.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.241 -0.89 . . . . 1.34 109.596 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.91 155.25 50.65 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.84 -0.695 . . . . 0.76 111.741 -178.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -44.37 -40.19 12.96 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.659 2.906 . . . . 1.89 114.073 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -62.46 -41.21 98.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 2.52 111.012 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -92.93 -32.42 14.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.144 0.497 . . . . 1.13 111.038 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -60.31 -39.5 87.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.615 -0.721 . . . . 2.52 111.305 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.05 -44.02 98.35 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.473 -0.87 . . . . 0.46 111.727 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -67.67 -45.57 74.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.247 . . . . 2.04 111.422 178.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.32 -60.21 3.49 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.239 0.337 . . . . 1.07 111.469 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.621 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 32.3 mt-10 -62.4 -36.14 81.4 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.823 -0.351 . . . . 1.96 110.973 -174.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -70.5 -41.84 72.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.278 -0.419 . . . . 2.74 110.974 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.3 p -69.68 -32.48 71.12 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.936 -0.306 . . . . 0.65 110.515 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 46.2 mm -59.51 -39.06 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.787 -0.449 . . . . 1.79 109.787 173.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.621 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 52.3 mt-10 -60.48 -43.07 97.35 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.343 -0.389 . . . . 2.82 110.47 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.2 mt -65.63 -46.06 90.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 1.2 111.05 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -31.59 71.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.225 0.535 . . . . 1.23 110.421 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.473 ' NH2' ' HG2' ' A' ' 90' ' ' GLU . 43.2 mtm180 -69.84 -35.98 75.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.871 -0.604 . . . . 5.02 110.457 174.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.3 98.22 Favored Glycine 0 N--CA 1.451 -0.325 0 O-C-N 123.325 0.391 . . . . 0.72 113.005 -176.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.9 mm -59.01 -49.07 84.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.202 0.525 . . . . 1.23 110.533 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 20.6 pttp -81.29 -7.71 59.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.866 -0.606 . . . . 3.16 111.232 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -77.34 -39.88 46.05 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.3 0.571 . . . . 1.33 109.983 174.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -86.92 10.03 17.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.613 -0.721 . . . . 3.64 109.645 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.697 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.4 m-85 -98.43 -40.23 8.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.574 -0.739 . . . . 1.28 110.017 162.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.601 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 18.9 m-85 -55.35 -38.99 69.49 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.168 0.509 . . . . 1.78 111.251 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.7 p -70.66 -1.97 12.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.272 -0.876 . . . . 1.51 112.817 -173.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.7 2.31 75.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.626 -0.797 . . . . 1.16 111.345 -175.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -90.53 169.93 10.62 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.035 -0.728 . . . . 2.22 109.035 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.1 mt-10 -142.59 106.09 5.46 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.582 0.23 . . . . 1.75 110.751 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.566 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 23.0 Cg_endo -64.74 141.09 70.62 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.434 2.09 . . . . 0.71 111.304 174.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.4 t -72.56 161.26 31.02 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.055 -0.72 . . . . 2.17 109.055 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.503 ' HB3' ' HZ2' ' A' ' 107' ' ' LYS . 0.3 OUTLIER -62.2 -19.63 63.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.818 0.342 . . . . 3.31 111.145 -177.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.21 -40.92 86.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.254 -0.43 . . . . 2.24 110.185 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -58.27 -41.48 84.42 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.43 0.633 . . . . 1.73 110.243 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.49 -50.75 66.21 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.92 -1.036 . . . . 1.56 110.42 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -53.51 -52.82 58.38 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.404 -0.362 . . . . 2.31 110.951 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.72 86.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.912 -0.585 . . . . 1.19 111.321 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.6 m -66.74 -39.02 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.284 -0.416 . . . . 1.84 111.586 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 48.8 t -77.93 -37.54 23.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.551 0.691 . . . . 0.66 109.377 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -54.24 -39.83 67.15 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.792 -1.095 . . . . 2.26 110.727 173.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 4.6 tt0 -74.28 -32.4 62.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 116.569 -0.287 . . . . 2.27 110.385 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 99.3 t -59.21 -45.22 93.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.255 0.55 . . . . 0.91 110.358 172.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.25 -28.0 65.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.096 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.504 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 33.3 ttpt -61.21 -42.23 98.23 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.822 -0.807 . . . . 1.51 108.822 177.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.494 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.3 mp -71.87 -51.69 21.07 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.188 -0.915 . . . . 1.68 111.374 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.612 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 0.0 OUTLIER -69.89 -36.92 75.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 119.223 -0.991 . . . . 2.2 111.862 -167.243 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -64.6 -30.27 71.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.826 0.346 . . . . 2.44 111.146 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.15 -4.85 59.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.506 0.558 . . . . 1.16 112.506 -176.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.491 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 55.8 mtm -75.45 161.34 29.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.5 -0.48 . . . . 1.15 111.771 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.8 m -59.67 144.15 48.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.784 -0.644 . . . . 1.57 109.785 170.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.98 -40.79 94.79 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.555 0.217 . . . . 2.21 111.378 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.34 -29.6 70.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 1.18 110.636 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.28 -37.56 63.17 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.446 -0.662 . . . . 0.35 111.446 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 97.1 mttt -65.76 -46.89 77.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.261 0.553 . . . . 1.84 109.902 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.36 -35.56 81.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.414 -0.812 . . . . 1.15 111.472 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -76.04 -33.59 59.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.002 0.429 . . . . 0.55 110.006 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.705 -0.679 . . . . 0.49 110.146 172.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.502 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.56 -6.31 70.69 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 116.013 -0.54 . . . . 0.27 113.451 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -95.53 -50.55 4.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.226 0.536 . . . . 2.95 110.143 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -81.01 -20.92 40.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.2 -0.909 . . . . 1.83 111.168 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.668 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 12.4 m-85 -137.3 69.99 54.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.764 0.316 . . . . 0.91 111.102 174.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.17 -42.17 59.71 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.173 2.582 . . . . 1.06 113.067 -178.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 138' ' ' PHE . 30.7 t80 -61.87 -46.73 88.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.404 -0.362 . . . . 2.9 111.37 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.417 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 80.7 mt -72.45 -43.09 64.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.023 -0.271 . . . . 1.67 110.911 -177.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.502 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.86 -39.42 77.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.762 0.315 . . . . 1.04 110.225 177.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 38.9 ttpt -47.27 -66.49 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 3.06 111.115 173.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.404 ' HA ' ' HB3' ' A' ' 147' ' ' LYS . 3.3 m -64.78 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.515 -0.766 . . . . 0.5 112.824 -174.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.499 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 21.6 m-85 -76.14 -48.99 18.52 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.847 -0.741 . . . . 0.92 110.68 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -66.24 -38.7 88.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.4 -0.363 . . . . 2.58 111.151 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 13.5 m -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 1.81 111.806 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 83.62 12.46 77.84 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.692 -0.766 . . . . 1.41 112.574 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 142' ' ' VAL . 9.7 tppt? -61.5 -53.85 50.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 2.46 110.647 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.15 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 1.07 110.657 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.66 85.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.841 -0.618 . . . . 1.12 111.071 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 41.9 mmtm -69.95 -21.07 63.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.086 0.469 . . . . 3.27 110.629 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -91.71 -39.71 11.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.758 -0.656 . . . . 0.68 110.616 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -85.94 -4.07 59.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 1.18 112.278 -177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 110.926 -0.87 . . . . 1.62 110.926 -174.298 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 11.4 p90 . . . . . 0 C--O 1.234 0.282 0 CA-C-O 120.985 0.421 . . . . 2.09 110.467 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -123.77 153.39 41.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.534 -0.543 . . . . 3.54 109.534 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.668 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 70.6 t80 -54.45 -45.32 73.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.281 0.562 . . . . 2.56 109.576 175.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -61.93 -27.7 69.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.148 -0.933 . . . . 4.16 112.064 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -79.44 -23.21 43.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.091 0.472 . . . . 2.57 110.329 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.44 133.71 84.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.184 -0.673 . . . . 1.31 109.184 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -44.25 110.46 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.14 2.56 . . . . 0.7 112.249 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.78 -21.84 66.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.493 -0.776 . . . . 1.23 112.209 -171.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.42 -35.42 80.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.332 0.587 . . . . 1.37 110.316 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.654 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 37.5 t80 -84.42 -29.4 26.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.09 -0.959 . . . . 1.08 110.956 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 11.9 mtm180 -65.95 -27.15 67.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.703 0.764 . . . . 2.1 109.059 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.41 -24.67 66.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.469 -1.241 . . . . 1.02 110.24 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.507 HD23 ' HG3' ' A' ' 147' ' ' LYS . 9.9 mt -97.55 1.78 49.33 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.639 -0.709 . . . . 1.49 110.191 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.603 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 96.0 mtp -96.47 137.37 21.54 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.153 -0.476 . . . . 1.65 110.071 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.06 142.03 95.94 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.626 2.217 . . . . 1.12 111.678 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.69 -19.07 51.58 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.464 2.776 . . . . 1.3 112.472 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.444 ' O ' HD12 ' A' ' 66' ' ' LEU . 4.0 mm-40 -62.57 -55.25 29.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.598 -0.728 . . . . 2.26 109.616 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.87 -28.6 65.78 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.482 -0.781 . . . . 1.39 111.01 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 35.5 mtp180 -67.12 -48.4 68.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 2.54 110.802 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 24.8 t70 -53.7 -46.82 70.86 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.515 0.198 . . . . 1.06 111.028 176.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.639 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 40.3 t80 -53.44 -60.3 3.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.985 -0.552 . . . . 0.73 111.049 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.504 HD23 ' CE1' ' A' ' 100' ' ' TYR . 83.8 mt -74.75 -4.66 38.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 119.31 0.959 . . . . 1.75 112.388 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 19' ' ' ARG . 37.8 mt-30 -71.92 -46.26 58.25 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 122.314 -0.241 . . . . 2.56 111.405 162.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.494 HD22 ' HA ' ' A' ' 21' ' ' PHE . 11.1 p30 -83.37 -26.88 30.09 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.525 0.565 . . . . 1.84 112.525 -175.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.663 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -63.13 134.9 56.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.841 -0.429 . . . . 1.7 109.841 166.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.8 m -159.23 55.27 0.4 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.236 0.458 . . . . 2.16 112.236 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.0 t70 71.98 143.06 0.06 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.325 0.584 . . . . 2.39 111.238 176.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.02 -49.14 4.07 Favored Glycine 0 N--CA 1.451 -0.32 0 N-CA-C 110.776 -0.93 . . . . 1.47 110.776 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -78.72 -49.43 13.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.112 -0.544 . . . . 2.25 110.28 173.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.422 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 89.2 mttt -55.32 -26.45 40.73 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.377 0.608 . . . . 1.89 110.703 174.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 14.9 m -64.69 -32.87 74.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.212 -0.903 . . . . 1.37 111.102 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.8 p -90.62 -23.61 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.23 -0.441 . . . . 0.85 110.512 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.451 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.2 mm? -54.59 -49.03 71.39 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.49 -0.323 . . . . 1.65 110.895 171.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 20.9 ptmt -65.43 -27.67 68.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.424 -0.353 . . . . 2.89 111.407 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -67.26 -37.33 83.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 1.96 110.157 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.4 t -73.54 -53.97 16.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.252 0.549 . . . . 0.98 110.468 177.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.601 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 27.5 m-85 -53.93 -45.11 71.14 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.345 1.239 . . . . 1.08 114.345 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -79.08 -1.4 35.64 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 119.988 -0.685 . . . . 2.71 111.16 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -99.82 17.08 21.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.394 0.616 . . . . 1.57 109.668 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -88.06 -160.61 36.01 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.444 -0.798 . . . . 1.54 111.62 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.78 160.8 95.45 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 123.334 -1.527 . . . . 1.99 112.256 -1.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -112.52 127.29 56.02 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.136 0.493 . . . . 1.72 110.252 177.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -65.65 -21.98 66.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.862 -1.063 . . . . 4.11 110.996 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.77 141.48 20.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.735 -0.666 . . . . 1.53 110.093 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.4 m -57.72 -28.31 63.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.242 -0.89 . . . . 1.72 112.215 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.64 -34.93 69.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.256 -0.429 . . . . 2.24 111.695 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.24 -34.22 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.689 0.255 . . . . 2.26 111.689 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m -64.57 -41.02 96.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.309 0.576 . . . . 1.69 109.821 176.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.9 mt -67.19 -43.14 88.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.392 -0.822 . . . . 1.2 110.561 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -58.11 -47.25 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.364 -0.835 . . . . 1.29 110.824 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.46 77.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.084 -0.507 . . . . 1.21 110.481 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.417 HD22 HD11 ' A' ' 33' ' ' LEU . 21.3 mt -69.74 -40.32 76.26 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.529 -0.759 . . . . 1.13 110.891 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -66.56 -23.5 66.22 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.848 0.356 . . . . 1.87 111.776 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -80.41 -26.59 38.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.097 0.475 . . . . 3.57 110.622 176.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -91.95 -58.91 2.25 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.977 -0.556 . . . . 2.01 111.058 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.5 t -131.02 104.15 15.36 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-O 121.294 0.569 . . . . 1.68 109.493 -175.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.08 -52.9 7.48 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 123.645 2.897 . . . . 0.84 112.129 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -61.31 -41.38 96.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.612 -1.176 . . . . 2.45 112.196 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.7 -40.01 73.11 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 119.443 -0.903 . . . . 2.03 109.639 -173.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.591 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.69 -36.6 93.51 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 114.614 -1.175 . . . . 0.41 111.61 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.82 94.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.719 0.295 . . . . 1.19 110.652 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -56.99 -59.66 4.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.926 -0.579 . . . . 2.7 110.911 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.97 -32.91 59.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.421 . . . . 1.12 111.744 -177.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.591 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -62.52 -55.61 25.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 1.7 110.484 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.473 ' HZ1' ' HB3' ' A' ' 65' ' ' LYS . 9.0 mtpm? -67.42 -33.09 74.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.548 0.69 . . . . 4.35 110.104 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.495 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 15.2 tp -66.52 -50.38 63.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.959 -1.019 . . . . 2.09 111.83 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.505 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.9 OUTLIER -74.57 -21.73 59.35 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.185 -0.672 . . . . 3.07 109.185 -174.433 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.49 99.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.905 -1.043 . . . . 1.26 110.648 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.495 ' HE1' ' HA ' ' A' ' 66' ' ' LEU . 28.4 mtm -63.45 -44.3 94.9 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.483 -0.562 . . . . 1.21 109.483 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.42 -49.21 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 114.996 -1.002 . . . . 0.79 110.299 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -62.45 -36.69 83.23 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 115.554 -0.748 . . . . 2.03 111.517 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -63.79 -41.12 98.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.92 0.39 . . . . 1.66 111.211 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 60.2 mttp -67.96 -44.88 75.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.213 -0.449 . . . . 2.14 110.039 177.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 79.1 mt -68.48 -22.57 27.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.456 0.646 . . . . 1.1 110.614 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.14 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.791 0.805 . . . . 1.18 109.744 177.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.46 -2.04 56.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.421 -1.263 . . . . 1.11 110.397 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.9 tp -93.82 134.77 35.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.403 -0.817 . . . . 1.34 110.114 -174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.39 155.41 40.18 Favored Glycine 0 C--O 1.225 -0.445 0 CA-C-O 119.669 -0.517 . . . . 0.76 112.619 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -43.19 -43.21 10.06 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 124.072 3.182 . . . . 1.89 114.49 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -66.22 -54.13 28.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.719 0.295 . . . . 2.52 110.265 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.67 -32.0 63.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.462 -0.495 . . . . 1.13 110.59 -174.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -61.53 -51.94 66.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 2.52 111.341 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.04 -34.62 89.55 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.356 -0.926 . . . . 0.46 111.214 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.86 -49.1 64.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.029 -0.585 . . . . 2.04 112.252 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.44 63.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.762 -0.654 . . . . 1.07 111.753 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.75 -20.5 63.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.899 -0.591 . . . . 1.96 111.142 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 14.4 tppt? -90.22 -42.28 11.11 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.079 0.466 . . . . 2.74 111.074 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -71.43 -43.78 66.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.99 0.424 . . . . 0.65 110.998 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.469 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 77.9 mt -67.85 -30.37 48.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 1.79 111.935 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 10.6 pt-20 -67.15 -28.73 68.37 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.15 -0.62 . . . . 2.82 109.981 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.1 mt -67.29 -45.15 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 109.401 -0.592 . . . . 1.2 109.401 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.25 -39.16 91.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.79 -0.641 . . . . 1.23 110.604 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 19.1 mtm180 -68.41 -28.75 67.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.645 -0.707 . . . . 5.02 110.617 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -73.78 -31.67 60.03 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.266 -0.492 . . . . 0.72 112.351 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.16 -50.63 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.034 0.445 . . . . 1.23 110.274 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -79.28 -7.71 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 3.16 110.942 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.76 71.7 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.425 -0.583 . . . . 1.33 109.425 168.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.622 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 78.6 mtp180 -85.44 -3.94 59.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.805 -0.634 . . . . 3.64 110.0 175.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -88.25 -32.21 18.64 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.988 -0.685 . . . . 1.28 109.457 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.655 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 35.2 m-85 -69.6 -54.66 12.95 Favored 'General case' 0 N--CA 1.46 0.047 0 CA-C-O 121.022 0.439 . . . . 1.78 110.631 176.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 p -61.21 -26.92 68.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.273 0.842 . . . . 1.51 113.273 -172.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 103.47 -10.7 53.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.62 -0.8 . . . . 1.16 112.141 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.622 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 91.5 m-20 -85.07 57.95 4.74 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.302 -0.258 . . . . 2.22 110.302 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.93 125.61 18.26 Favored Pre-proline 0 N--CA 1.464 0.251 0 N-CA-C 112.797 0.666 . . . . 1.75 112.797 -172.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.33 142.75 30.56 Favored 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.811 2.341 . . . . 0.71 111.324 175.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -78.18 169.47 18.21 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.493 -0.558 . . . . 2.17 109.493 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.515 ' HZ3' ' HB2' ' A' ' 107' ' ' LYS . 4.3 ttmp? -61.33 -34.59 75.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 118.26 0.482 . . . . 3.31 110.648 -174.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -65.35 -30.21 71.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.798 -0.637 . . . . 2.24 110.982 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -63.56 -40.21 96.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.246 0.546 . . . . 1.73 110.235 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.518 ' HA ' ' OG ' ' A' ' 113' ' ' SER . 11.0 mp -71.39 -42.42 68.41 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.515 -0.766 . . . . 1.56 110.652 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -55.76 -42.73 75.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.094 0.473 . . . . 2.31 110.068 176.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.531 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -67.51 -39.08 85.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.854 -0.612 . . . . 1.19 112.337 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.518 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 3.9 p -74.29 -33.31 63.21 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.436 0.532 . . . . 1.84 112.436 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.0 m -74.3 -27.41 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 107.83 -1.174 . . . . 0.66 107.83 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 23.0 ttmm -64.24 -35.42 80.78 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.882 -1.508 . . . . 2.26 110.775 177.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 28.5 mt-10 -77.02 -40.05 47.98 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.112 -0.635 . . . . 2.27 111.076 178.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.5 m -66.79 -24.62 32.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.359 -0.536 . . . . 0.91 110.229 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.3 mt -84.19 -37.83 21.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.387 -0.37 . . . . 1.75 111.117 171.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.438 ' HB3' ' HA ' ' A' ' 116' ' ' GLU . 36.5 ttpt -55.86 -44.12 77.77 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.297 -1.001 . . . . 1.51 108.297 176.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.409 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.4 mp -69.25 -54.47 14.56 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 113.947 -1.478 . . . . 1.68 111.867 174.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.642 ' HE1' ' CE2' ' A' ' 121' ' ' TYR . 61.4 t80 -69.37 -31.31 69.63 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 119.684 -0.806 . . . . 2.2 111.803 -167.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -66.33 -28.44 68.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.848 0.356 . . . . 2.44 110.976 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.83 -3.36 58.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.167 0.803 . . . . 1.16 113.167 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.0 mtm -77.4 158.18 30.2 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.851 -0.74 . . . . 1.15 110.663 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 34.6 t -66.18 149.73 49.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.796 -0.446 . . . . 1.57 109.796 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -53.11 -43.75 67.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.603 0.24 . . . . 2.21 111.266 -176.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -70.02 -34.91 73.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 1.18 110.973 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.5 -45.14 80.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.952 -0.567 . . . . 0.35 112.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -74.73 -24.97 58.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.328 . . . . 1.84 110.485 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.86 -45.28 94.48 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.538 0.685 . . . . 1.15 110.509 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.15 -28.93 63.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.859 -1.064 . . . . 0.55 109.679 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 1.649 ' HE1' ' CE2' ' A' ' 132' ' ' PHE . 32.0 t80 -62.19 -30.05 70.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.324 -0.853 . . . . 0.49 109.295 171.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.09 -7.24 88.58 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.664 -0.698 . . . . 0.27 112.936 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -88.98 -40.98 12.64 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-O 121.342 0.591 . . . . 2.95 110.155 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.445 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 8.6 mm100 -85.98 -30.34 22.82 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.091 -0.959 . . . . 1.83 110.57 -177.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.669 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 58.4 m-85 -132.96 70.86 78.53 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.057 0.456 . . . . 0.91 110.635 173.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.24 -27.28 72.21 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.953 2.435 . . . . 1.06 112.088 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.651 ' HE2' ' CE1' ' A' ' 138' ' ' PHE . 25.8 t80 -66.34 -39.49 89.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.799 -0.637 . . . . 2.9 110.399 -178.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.3 -42.11 17.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.105 -0.498 . . . . 1.67 110.793 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.81 -34.31 71.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.475 -0.565 . . . . 1.04 109.475 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 28.6 tptp -50.5 -75.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.163 -0.926 . . . . 3.06 111.633 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.5 m -63.68 -27.64 43.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.794 -0.639 . . . . 0.5 112.616 -172.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.79 -44.94 69.05 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.382 -0.527 . . . . 0.92 110.446 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -83.17 -27.27 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.401 -0.363 . . . . 2.58 111.265 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 9.7 t -71.51 -19.59 62.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.927 0.394 . . . . 1.81 110.67 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.404 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 102.74 -10.35 55.85 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.619 -0.801 . . . . 1.41 112.583 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.507 ' HG3' HD23 ' A' ' 13' ' ' LEU . 46.2 tptt -54.55 -48.15 72.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.854 0.359 . . . . 2.46 110.79 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -75.36 -44.77 43.27 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.24 -0.436 . . . . 1.07 110.922 178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -56.13 -40.07 73.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.696 -0.684 . . . . 1.12 112.611 -175.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.404 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 4.8 mptp? -83.41 -16.55 45.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 3.27 110.901 -177.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -78.81 -35.13 44.64 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.45 -0.574 . . . . 0.68 109.45 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -77.58 -27.25 51.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.754 -0.657 . . . . 1.18 110.955 176.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.289 0 C-N-CA 120.945 -0.645 . . . . 1.62 111.958 -179.557 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.664 ' HE1' ' CE2' ' A' ' 1' ' ' PHE . 55.2 t80 . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 121.533 0.682 . . . . 2.09 112.179 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -123.12 114.91 20.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.647 -0.706 . . . . 3.54 109.21 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.646 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 59.5 t80 -68.35 -24.07 64.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.314 0.578 . . . . 2.56 110.204 -178.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.1 -2.73 58.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.59 -0.732 . . . . 4.16 110.394 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -94.08 -10.76 32.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.549 0.69 . . . . 2.57 109.529 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.0 mt -80.74 131.6 60.16 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.345 -0.843 . . . . 1.31 109.021 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -37.81 115.36 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.745 2.964 . . . . 0.7 112.679 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.17 -17.78 64.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 1.23 111.551 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -74.67 -26.58 59.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.92 0.867 . . . . 1.37 109.299 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.648 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 65.4 t80 -85.13 -31.42 23.31 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.228 -1.351 . . . . 1.08 110.656 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -67.88 -18.55 64.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.301 0.572 . . . . 2.1 110.028 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.71 -21.64 64.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.185 -0.916 . . . . 1.02 110.748 175.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.489 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 90.7 mt -87.4 -6.99 58.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.069 -0.514 . . . . 1.49 110.916 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 63.6 mtt -86.75 126.98 61.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.341 -0.391 . . . . 1.65 110.63 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -75.35 155.39 41.31 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.36 2.04 . . . . 1.12 111.572 175.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.17 -49.37 7.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.577 2.851 . . . . 1.3 113.492 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -51.36 -51.42 54.7 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.831 0.348 . . . . 2.26 111.605 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.34 -28.18 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.809 0.337 . . . . 1.39 111.405 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -76.55 -39.01 54.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.359 -0.382 . . . . 2.54 110.465 178.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -46.71 -55.38 7.87 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.934 0.771 . . . . 1.06 110.976 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.652 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 40.8 t80 -56.43 -63.39 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.673 -0.694 . . . . 0.73 112.366 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -75.1 -5.36 43.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 119.223 0.92 . . . . 1.75 111.72 -174.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -74.41 -37.49 63.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.008 0.432 . . . . 2.56 110.377 162.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.37 -48.09 74.14 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.786 -0.643 . . . . 1.84 111.717 -177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.59 137.09 56.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.195 0.522 . . . . 1.7 110.578 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -131.58 -64.22 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.683 -0.689 . . . . 2.16 111.93 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 2.7 p-10 -135.76 -90.49 0.3 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.599 0.592 . . . . 2.39 112.599 -173.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.438 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -62.54 -19.73 60.58 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 114.153 0.421 . . . . 1.47 114.153 -171.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -76.82 -34.82 57.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.983 0.391 . . . . 2.25 110.93 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.442 ' HD3' ' O ' ' A' ' 1' ' ' PHE . 95.7 mttt -65.67 -27.38 68.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.524 0.678 . . . . 1.89 110.487 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 66.0 m -60.71 -38.18 84.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.917 -1.038 . . . . 1.37 111.246 176.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.2 p -89.91 -21.87 6.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.982 -0.554 . . . . 0.85 111.581 -173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.466 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 3.1 mm? -50.41 -50.91 50.46 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.804 0.298 . . . . 1.65 111.804 172.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 9.2 ptpp? -65.72 -25.02 67.11 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.809 0.338 . . . . 2.89 111.395 -176.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.55 -31.58 68.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.224 0.535 . . . . 1.96 109.891 176.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 89.7 t -74.71 -51.19 23.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.489 -0.778 . . . . 0.98 110.19 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -53.69 -42.79 68.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.233 0.827 . . . . 1.08 113.233 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.41 21.55 2.85 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.876 -0.73 . . . . 2.71 111.023 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -122.11 12.38 10.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.827 -0.624 . . . . 1.57 110.081 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.03 -156.82 10.41 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.71 -0.677 . . . . 1.54 112.19 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.69 165.12 84.61 Favored 'Cis proline' 0 C--N 1.343 0.281 0 C-N-CA 123.809 -1.33 . . . . 1.99 112.981 0.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.441 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 54.7 m-85 -123.12 124.81 43.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.604 -0.725 . . . . 1.72 110.379 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -79.68 -20.53 46.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.211 -0.904 . . . . 4.11 110.575 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.497 HD22 ' HG3' ' A' ' 47' ' ' GLU . 5.4 p30 -144.75 174.27 11.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.142 -0.481 . . . . 1.53 110.889 -171.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.1 m -72.06 -39.5 69.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.482 -0.326 . . . . 1.72 111.091 -178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -59.05 -42.29 89.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.101 -0.499 . . . . 2.24 111.751 -172.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' HG3' HD22 ' A' ' 44' ' ' ASN . 46.7 mt-10 -54.96 -39.57 69.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.802 0.334 . . . . 2.26 111.485 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.7 m -72.71 -42.09 64.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.245 -0.434 . . . . 1.69 110.442 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 60.7 mt -65.46 -38.33 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 1.2 110.281 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.58 -52.51 64.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.375 -0.829 . . . . 1.29 111.186 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.74 77.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.752 -0.658 . . . . 1.21 110.328 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 59' ' ' LEU . 37.1 mt -70.3 -40.66 74.11 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.12 -0.946 . . . . 1.13 111.41 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -66.52 -23.49 66.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.064 0.459 . . . . 1.87 111.26 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.472 ' HB2' ' HZ2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -78.33 -50.98 10.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 3.57 109.92 175.438 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -67.35 -62.21 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.784 -0.643 . . . . 2.01 111.909 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -132.33 90.8 33.14 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 116.043 -0.526 . . . . 1.68 109.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -41.55 -57.51 1.43 Allowed 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.829 3.019 . . . . 0.84 113.685 -171.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 30.5 tt0 -62.69 -27.03 68.97 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.234 -0.894 . . . . 2.45 111.982 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 2.2 tt -70.79 -46.25 63.2 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.786 -1.19 . . . . 2.03 107.786 -178.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.98 -32.07 83.02 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 114.407 -1.269 . . . . 0.41 111.318 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.43 91.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.666 0.269 . . . . 1.19 110.457 174.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 61.7 mttp -54.54 -53.4 54.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.995 -0.548 . . . . 2.7 110.125 175.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.25 -41.61 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.708 -0.678 . . . . 1.12 111.02 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.39 -55.19 37.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.785 -0.643 . . . . 1.7 110.698 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.567 ' O ' ' HG3' ' A' ' 69' ' ' MET . 8.6 mtpm? -63.48 -41.14 98.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.343 0.592 . . . . 4.35 110.304 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.514 HD23 ' HB2' ' A' ' 21' ' ' PHE . 16.4 tp -62.97 -50.59 70.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.331 -0.85 . . . . 2.09 112.298 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -77.23 -17.23 58.62 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.881 -0.785 . . . . 3.07 108.881 -172.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.0 81.12 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.625 -0.716 . . . . 1.26 109.879 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 21.5 mtm -67.86 -46.85 70.56 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.281 -0.637 . . . . 1.21 109.281 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 m -62.13 -35.27 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.625 -0.716 . . . . 0.79 109.832 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -65.42 -41.99 92.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.004 -0.544 . . . . 2.03 110.663 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 m -59.71 -29.72 68.3 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.197 0.523 . . . . 1.66 110.459 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.584 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 87.7 mttt -82.11 -47.01 13.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.557 -0.747 . . . . 2.14 110.837 177.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.9 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 1.1 111.418 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.03 -31.12 71.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.475 0.655 . . . . 1.18 110.274 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.47 58.69 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.836 -1.074 . . . . 1.11 110.669 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.568 ' CD2' ' HA ' ' A' ' 132' ' ' PHE . 97.4 mt -43.59 140.39 1.8 Allowed 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 112.74 0.644 . . . . 1.34 112.74 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 159.6 39.23 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.592 -1.003 . . . . 0.76 110.592 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -43.5 -35.82 6.32 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.561 2.841 . . . . 1.89 113.522 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.0 -48.35 37.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.523 -0.308 . . . . 2.52 111.15 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.428 ' HB1' ' HB3' ' A' ' 77' ' ' LEU . . . -72.41 -34.87 68.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.333 0.587 . . . . 1.13 110.146 -174.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -58.38 -44.66 88.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.878 -1.055 . . . . 2.52 110.741 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.66 -43.97 97.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.167 -0.539 . . . . 0.46 112.54 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -66.87 -44.09 81.83 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.529 0.204 . . . . 2.04 110.951 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.69 -46.64 81.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.131 0.491 . . . . 1.07 111.28 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 45.5 mt-10 -66.32 -42.43 88.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.66 -0.7 . . . . 1.96 110.529 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.09 -46.94 69.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.396 -0.366 . . . . 2.74 111.134 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -60.39 -39.88 88.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.762 0.315 . . . . 0.65 110.757 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.1 mt -65.5 -39.69 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 116.392 -0.367 . . . . 1.79 110.818 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 54.4 mt-10 -56.62 -48.21 77.97 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.069 0.461 . . . . 2.82 110.361 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.59 -44.23 96.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.471 -0.786 . . . . 1.2 110.892 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.6 66.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.05 0.452 . . . . 1.23 110.941 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -62.89 -38.72 92.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.987 -0.551 . . . . 5.02 110.78 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -71.74 -39.31 60.2 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.06 -0.591 . . . . 0.72 113.065 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.41 -54.1 38.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.854 0.359 . . . . 1.23 110.779 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.548 ' HB2' ' HZ2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -87.17 29.94 0.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 3.16 110.07 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -112.83 -34.85 5.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.994 -1.003 . . . . 1.33 108.755 164.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -80.9 -13.38 58.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 3.64 109.798 177.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -77.38 -34.05 55.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.463 -0.569 . . . . 1.28 109.463 167.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.67 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 1.2 m-85 -77.83 -35.92 50.65 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.956 0.724 . . . . 1.78 112.956 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -65.04 -9.63 23.54 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.586 0.587 . . . . 1.51 112.586 -174.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.89 14.68 22.42 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.754 -0.736 . . . . 1.16 111.531 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -117.88 -177.73 3.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.932 -0.396 . . . . 2.22 109.932 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.429 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.4 mt-10 -142.52 105.19 5.45 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.318 -0.401 . . . . 1.75 110.729 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.1 Cg_endo -58.1 143.85 95.94 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.835 1.69 . . . . 0.71 110.133 170.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.6 p -76.04 170.21 16.71 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.851 -0.426 . . . . 2.17 109.851 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.4 tptm -64.16 -30.37 71.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.136 -0.69 . . . . 3.31 109.136 178.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -69.86 -30.11 67.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.373 -0.831 . . . . 2.24 110.81 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -60.57 -46.28 90.81 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.801 -0.444 . . . . 1.73 109.801 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.5 mp -65.77 -44.94 84.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.529 -0.76 . . . . 1.56 110.918 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 57.6 mtpt -59.41 -39.97 85.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.173 0.511 . . . . 2.31 110.445 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.425 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -69.4 -42.89 74.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.727 -0.669 . . . . 1.19 111.413 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.2 p -61.79 -38.16 87.02 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.072 -0.251 . . . . 1.84 111.558 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.501 ' O ' HD21 ' A' ' 118' ' ' LEU . 7.8 m -80.76 -25.83 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.395 0.617 . . . . 0.66 109.447 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 41.1 ttmt -55.95 -44.56 78.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.701 -0.681 . . . . 2.26 110.994 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.487 ' O ' HD11 ' A' ' 120' ' ' LEU . 24.0 mt-10 -72.71 -34.21 66.98 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.271 -0.572 . . . . 2.27 111.006 -176.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -66.16 -34.03 67.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.144 -0.622 . . . . 0.91 110.505 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.501 HD21 ' O ' ' A' ' 114' ' ' VAL . 4.1 mm? -73.19 -33.78 65.59 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.923 -0.486 . . . . 1.75 110.313 172.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.01 -45.64 90.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.996 -0.742 . . . . 1.51 108.996 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.487 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -72.27 -49.9 31.29 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.663 -1.153 . . . . 1.68 111.53 176.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -69.79 -37.47 76.33 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 119.849 -0.741 . . . . 2.2 111.747 -168.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.466 ' HE3' HD13 ' A' ' 118' ' ' LEU . 93.0 mttt -64.46 -29.88 70.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.931 0.396 . . . . 2.44 110.896 178.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.17 -6.68 59.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 1.16 112.397 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.2 mtm -76.72 157.08 31.99 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.119 -0.633 . . . . 1.15 110.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 70.5 m -70.06 153.39 43.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 121.06 -0.256 . . . . 1.57 110.705 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -54.97 -46.07 75.04 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.168 0.433 . . . . 2.21 112.168 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.7 75.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.775 0.322 . . . . 1.18 111.076 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -68.14 -38.11 87.72 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.016 -0.538 . . . . 0.35 112.143 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.73 -46.39 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.323 0.582 . . . . 1.84 110.154 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.05 -34.41 77.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.134 -0.939 . . . . 1.15 111.443 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -74.18 -31.66 62.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.683 -0.488 . . . . 0.55 109.683 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.568 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . 89.7 t80 -64.07 -34.45 78.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.777 -0.647 . . . . 0.49 110.674 175.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.21 -4.91 57.79 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.133 -0.556 . . . . 0.27 113.475 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -91.59 -23.14 19.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.567 0.699 . . . . 2.95 110.088 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.584 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -108.81 -35.82 6.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.052 -0.976 . . . . 1.83 110.889 -173.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.653 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 44.5 m-85 -128.77 71.61 81.24 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.256 -0.646 . . . . 0.91 109.256 171.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.88 -33.88 62.53 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.016 2.478 . . . . 1.06 112.75 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.65 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 28.6 m-85 -65.98 -30.55 71.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.448 -0.342 . . . . 2.9 111.492 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.9 mp -77.48 -48.23 17.63 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.399 -0.52 . . . . 1.67 110.028 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.16 -31.55 65.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.545 0.688 . . . . 1.04 109.854 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 56.2 tttp -58.41 -75.09 0.05 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.804 -1.089 . . . . 3.06 111.43 171.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.5 -26.68 40.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 112.895 0.702 . . . . 0.5 112.895 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -71.63 -47.89 51.52 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.682 -0.407 . . . . 0.92 110.478 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.24 -23.91 47.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 2.58 111.188 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.7 t -70.71 -19.29 62.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.254 0.55 . . . . 1.81 109.775 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 96.86 -9.62 66.01 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.973 -0.632 . . . . 1.41 112.582 177.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.489 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 8.8 tmtm? -57.14 -50.7 71.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 2.46 110.408 -176.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.5 83.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 1.07 111.092 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.97 80.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.126 -0.488 . . . . 1.12 111.812 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 14.4 mmmm -75.36 -35.42 61.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.88 0.371 . . . . 3.27 110.352 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.667 ' HD2' ' CD1' ' A' ' 151' ' ' PHE . 22.2 t80 -61.77 -40.57 95.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.68 109.705 173.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.37 94.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.602 -0.727 . . . . 1.18 111.133 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.541 0 C-N-CA 120.731 -0.747 . . . . 1.62 111.587 -175.772 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.647 ' HD1' ' CD2' ' A' ' 1' ' ' PHE . 9.0 p90 . . . . . 0 C--O 1.237 0.413 0 CA-C-O 121.525 0.678 . . . . 2.09 110.906 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -107.88 138.11 44.71 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.71 -0.677 . . . . 3.54 109.584 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.66 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 22.5 t80 -70.72 -17.26 62.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.433 0.635 . . . . 2.56 109.619 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -92.74 2.35 56.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.31 -0.859 . . . . 4.16 110.127 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -106.38 -16.15 14.63 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.045 -0.525 . . . . 2.57 110.134 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.6 mt -76.6 133.9 70.06 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 108.319 -0.993 . . . . 1.31 108.319 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -43.06 116.2 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.298 2.665 . . . . 0.7 112.875 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.74 -22.56 67.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.983 -0.553 . . . . 1.23 111.491 -175.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.24 -34.45 78.04 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.129 0.966 . . . . 1.37 108.925 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 64.5 t80 -85.37 -24.57 27.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.673 -1.603 . . . . 1.08 110.49 -176.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -71.78 -20.46 61.86 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.401 0.62 . . . . 2.1 109.467 177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.61 -19.08 62.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.932 -1.031 . . . . 1.02 110.371 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.8 mt -96.39 12.98 29.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.593 -0.731 . . . . 1.49 110.304 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 59.8 mtt -100.42 128.75 29.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.217 -0.447 . . . . 1.65 110.604 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.68 137.35 63.24 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.379 2.053 . . . . 1.12 110.746 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.49 -29.58 24.93 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.779 2.986 . . . . 1.3 113.656 -175.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.506 ' O ' HD12 ' A' ' 66' ' ' LEU . 20.2 mp0 -64.54 -50.19 68.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.072 0.463 . . . . 2.26 110.236 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.18 -29.59 69.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.554 . . . . 1.39 110.796 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -68.55 -45.56 71.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.524 . . . . 2.54 110.389 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.43 -41.13 65.74 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.45 0.469 . . . . 1.06 111.436 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.628 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 34.2 t80 -60.59 -68.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.849 -0.614 . . . . 0.73 111.222 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.537 HD22 ' CE1' ' A' ' 100' ' ' TYR . 69.4 mt -70.01 -6.97 37.12 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 119.2 0.909 . . . . 1.75 112.069 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.81 -53.19 50.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.518 0.199 . . . . 2.56 110.801 163.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -81.0 -31.65 34.59 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.483 0.549 . . . . 1.84 112.483 -173.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.535 HD21 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -56.41 131.12 47.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.711 0.767 . . . . 1.7 111.023 173.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.1 m -124.37 178.61 5.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.593 -1.185 . . . . 2.16 109.374 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.77 -47.29 64.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.798 0.333 . . . . 2.39 111.644 -175.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.59 -48.75 79.3 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.959 -0.639 . . . . 1.47 112.538 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.89 -43.96 86.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.708 0.29 . . . . 2.25 110.999 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.07 -17.58 57.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.438 -0.346 . . . . 1.89 111.534 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.3 m -64.77 -43.64 92.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.454 0.645 . . . . 1.37 109.888 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.45 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 2.8 p -79.21 -29.69 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 CA-C-N 115.262 -0.881 . . . . 0.85 110.082 -176.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD11 HD22 ' A' ' 52' ' ' LEU . 4.2 mm? -54.88 -42.41 72.04 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 121.044 0.45 . . . . 1.65 110.167 169.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.476 ' HA ' ' CG2' ' A' ' 101' ' ' THR . 63.3 tttp -62.99 -29.64 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 2.89 111.019 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -77.99 -24.98 47.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.96 110.81 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.0 t -80.9 -57.2 5.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.717 0.77 . . . . 0.98 110.009 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.668 ' HD1' ' CD2' ' A' ' 37' ' ' PHE . 17.8 m-85 -54.52 -42.55 70.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.652 -1.158 . . . . 1.08 114.116 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.629 ' HE3' ' OG1' ' A' ' 101' ' ' THR . 5.1 mmpt? -86.1 8.27 21.48 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.966 -0.694 . . . . 2.71 111.346 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -102.8 -77.98 0.55 Allowed 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.512 -0.767 . . . . 1.57 108.975 169.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.432 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 44.56 -151.79 0.65 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.99 -0.624 . . . . 1.54 112.947 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -91.0 145.27 15.05 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 118.716 1.258 . . . . 1.99 111.421 -8.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 22.7 m-85 -112.18 120.42 41.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.472 0.653 . . . . 1.72 111.35 -173.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -81.13 -19.2 44.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.822 -1.081 . . . . 4.11 110.649 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.402 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -146.09 160.03 42.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.955 -0.566 . . . . 1.53 109.548 -174.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.0 m -66.29 -30.57 71.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.231 -0.441 . . . . 1.72 111.947 -174.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.402 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 41.0 tt0 -59.58 -39.45 84.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.968 -0.105 . . . . 2.24 111.234 -177.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.55 -46.38 90.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.615 -0.266 . . . . 2.26 111.311 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -65.76 -34.32 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 1.69 110.919 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 88.6 mt -67.2 -41.79 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 1.2 110.21 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -57.4 -51.76 68.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 1.29 111.249 177.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.29 -42.56 77.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 1.21 110.511 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.405 HD22 HD11 ' A' ' 33' ' ' LEU . 18.7 mt -66.64 -39.09 88.11 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.341 -0.845 . . . . 1.13 111.169 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -63.92 -31.02 72.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.87 111.03 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -73.99 -46.22 45.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.257 0.551 . . . . 3.57 110.293 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.45 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 61.0 mmtt -66.81 -59.0 3.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.526 -0.761 . . . . 2.01 111.737 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 m -140.65 101.98 6.54 Favored Pre-proline 0 C--N 1.311 -1.103 0 CA-C-O 121.274 0.559 . . . . 1.68 109.564 -176.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -43.52 -47.97 8.91 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.32 3.347 . . . . 0.84 112.798 -176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.541 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 11.7 pt-20 -62.86 -39.87 95.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.562 -1.199 . . . . 2.45 112.558 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -72.22 -40.86 67.48 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.758 0.79 . . . . 2.03 109.418 -172.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.08 -34.18 89.26 Favored Glycine 0 N--CA 1.441 -1.005 0 CA-C-N 114.427 -1.261 . . . . 0.41 111.62 176.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.53 -38.14 80.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.748 0.309 . . . . 1.19 110.365 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.0 mmmt -58.01 -60.16 4.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.98 -0.555 . . . . 2.7 110.697 177.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.14 -34.18 65.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 1.12 111.309 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.88 -66.06 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.425 . . . . 1.7 111.237 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 69' ' ' MET . 55.5 mtmt -67.04 -32.35 73.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.381 0.61 . . . . 4.35 110.641 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.506 HD12 ' O ' ' A' ' 17' ' ' GLU . 1.4 tp -65.81 -47.03 76.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.21 -0.904 . . . . 2.09 111.196 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -22.57 55.55 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.584 -0.895 . . . . 3.07 108.584 -176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.23 68.67 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.022 -0.99 . . . . 1.26 110.773 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 31.3 mtm -65.76 -46.99 76.71 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.635 -0.876 . . . . 1.21 108.635 172.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.524 ' HA ' ' HD3' ' A' ' 73' ' ' LYS . 48.3 t -58.06 -44.16 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.446 -1.252 . . . . 0.79 110.098 176.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -63.94 -39.81 95.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.321 -0.854 . . . . 2.03 110.339 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.8 t -58.97 -49.3 78.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.073 -0.512 . . . . 1.66 111.459 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -72.36 -36.27 68.72 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.056 -0.258 . . . . 2.14 111.017 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.9 mt -67.08 -30.23 48.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.085 0.469 . . . . 1.1 110.676 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.43 -30.09 71.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.431 0.634 . . . . 1.18 110.493 173.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.35 -4.5 59.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.277 -0.874 . . . . 1.11 110.697 -178.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.4 tp -91.12 139.73 30.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.372 -0.831 . . . . 1.34 109.847 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 155.61 53.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 0.76 111.967 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -44.5 -38.87 12.36 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.824 3.016 . . . . 1.89 113.835 -175.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -65.01 -57.02 9.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.116 0.484 . . . . 2.52 110.357 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 128' ' ' GLY . . . -75.61 -32.37 60.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 1.13 110.961 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -59.72 -39.5 84.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.669 -0.696 . . . . 2.52 110.726 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.28 97.71 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.259 -0.972 . . . . 0.46 111.527 177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.8 t80 -65.4 -41.94 93.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.566 0.222 . . . . 2.04 111.134 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.38 -43.43 79.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 1.07 111.038 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -84.72 -21.22 30.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.309 -0.405 . . . . 1.96 110.756 -177.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -73.61 -45.12 54.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.949 0.404 . . . . 2.74 110.06 176.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.7 p -62.26 -34.21 76.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.231 -0.44 . . . . 0.65 110.616 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.2 mt -68.77 -45.88 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.352 -0.386 . . . . 1.79 111.782 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.15 -29.31 70.69 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.59 -0.444 . . . . 2.82 110.922 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.9 mt -75.68 -44.9 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.15 0.5 . . . . 1.2 109.937 175.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.4 ' O ' ' HD3' ' A' ' 96' ' ' LYS . . . -64.54 -31.2 72.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.829 -0.623 . . . . 1.23 110.864 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -56.59 -51.89 66.93 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.092 -0.503 . . . . 5.02 110.582 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.73 94.7 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.996 -0.621 . . . . 0.72 112.961 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.8 mm -63.83 -52.85 51.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.342 . . . . 1.23 111.095 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.903 ' NZ ' ' HH ' ' A' ' 10' ' ' TYR . 9.9 mptt -83.86 -13.29 53.99 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.311 -0.556 . . . . 3.16 110.806 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.82 -24.94 67.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 118.327 0.512 . . . . 1.33 110.101 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.3 mtp180 -87.77 -24.84 23.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.074 -0.512 . . . . 3.64 110.072 175.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -75.2 -37.97 60.95 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.214 -0.594 . . . . 1.28 109.796 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.648 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 3.3 m-85 -52.85 -27.58 19.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.544 -0.753 . . . . 1.78 112.838 -176.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.629 ' OG1' ' HE3' ' A' ' 38' ' ' LYS . 17.5 p -131.05 32.96 4.23 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 118.427 -1.309 . . . . 1.51 113.273 -176.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 79.62 1.41 86.65 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.699 -0.763 . . . . 1.16 114.003 170.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 90.4 m-20 -88.71 52.81 2.52 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.969 -0.752 . . . . 2.22 108.969 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.456 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 34.3 mt-10 -53.1 115.41 7.45 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 114.469 -1.241 . . . . 1.75 113.395 -169.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 19.4 Cg_endo -64.61 154.07 74.12 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.859 2.373 . . . . 0.71 111.178 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.5 t -87.22 173.08 9.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.263 -0.643 . . . . 2.17 109.263 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -64.69 -22.91 67.09 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.224 -0.59 . . . . 3.31 110.787 -175.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.79 -44.16 96.91 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.175 -0.306 . . . . 2.24 110.175 175.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -57.26 -44.23 83.71 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.304 0.573 . . . . 1.73 110.214 177.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.04 -48.53 65.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.126 -0.943 . . . . 1.56 111.213 -178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -63.94 -32.39 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.018 0.437 . . . . 2.31 110.211 -177.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.07 65.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 1.19 111.423 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.0 p -62.49 -34.86 77.7 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.831 0.308 . . . . 1.84 111.831 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.426 ' CG1' ' HE2' ' A' ' 10' ' ' TYR . 2.7 m -84.49 -24.15 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.674 0.749 . . . . 0.66 109.286 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -62.75 -42.77 99.83 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.126 -0.943 . . . . 2.26 111.28 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.574 ' O ' HD21 ' A' ' 120' ' ' LEU . 21.8 mt-10 -69.1 -36.87 78.02 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 119.985 -0.686 . . . . 2.27 110.975 -178.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.12 -27.53 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.103 -0.639 . . . . 0.91 109.844 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.495 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.0 mt -74.59 -37.81 62.79 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.693 -0.484 . . . . 1.75 109.693 172.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -57.83 -42.71 84.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.232 0.539 . . . . 1.51 109.678 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.574 HD21 ' O ' ' A' ' 116' ' ' GLU . 4.2 mm? -69.25 -49.79 53.03 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.343 -0.844 . . . . 1.68 111.347 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.585 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 49.1 t80 -73.47 -29.36 62.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.907 -1.117 . . . . 2.2 111.665 -169.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -70.4 -38.92 74.72 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.588 -0.523 . . . . 2.44 109.588 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -92.15 68.85 5.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.514 0.673 . . . . 1.16 110.985 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.544 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 41.8 mtm -147.77 152.4 37.66 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.978 -1.01 . . . . 1.15 109.325 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.4 m -66.55 140.36 57.97 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.293 -0.262 . . . . 1.57 110.293 175.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -51.53 -42.14 61.56 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.401 0.519 . . . . 2.21 112.401 -168.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.46 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.958 0.355 . . . . 1.18 111.958 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.401 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -82.5 -29.76 35.25 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.89 -0.671 . . . . 0.35 111.537 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -71.06 -47.78 56.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.024 0.44 . . . . 1.84 110.29 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.8 65.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.83 -0.623 . . . . 1.15 111.193 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.16 -31.12 60.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.267 -0.424 . . . . 0.55 110.258 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -61.38 -27.69 68.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.761 -0.654 . . . . 0.49 110.38 176.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.63 -13.31 78.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.066 -0.588 . . . . 0.27 113.303 -178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -87.74 -39.95 14.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.736 0.779 . . . . 2.95 109.536 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -87.37 -36.11 17.97 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.662 -1.154 . . . . 1.83 111.539 -177.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.631 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 25.0 m-85 -128.78 71.67 81.3 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 120.797 0.332 . . . . 0.91 110.693 176.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -61.46 -40.51 47.49 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.906 2.404 . . . . 1.06 112.32 -176.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.615 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 60.5 t80 -62.46 -41.67 98.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 2.9 111.276 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 85.4 mt -76.02 -42.13 48.89 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.639 -0.424 . . . . 1.67 110.383 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.51 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.23 0.538 . . . . 1.04 110.05 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.615 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.6 tttt -49.63 -71.67 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.158 -0.928 . . . . 3.06 111.481 171.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.5 m -64.3 -25.85 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.406 -0.815 . . . . 0.5 112.559 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -71.27 -49.71 40.18 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 119.716 -0.794 . . . . 0.92 110.132 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -73.99 -34.3 64.14 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.298 -0.41 . . . . 2.58 111.2 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.5 t -66.03 -19.54 65.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.223 -0.444 . . . . 1.81 110.502 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.48 4.79 62.15 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.59 -0.814 . . . . 1.41 112.232 178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -64.9 -51.07 63.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.813 0.339 . . . . 2.46 110.303 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.39 -40.39 81.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.01 0.433 . . . . 1.07 110.223 177.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.495 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.91 -43.99 81.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.673 -0.694 . . . . 1.12 111.554 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.94 -25.47 61.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.259 -0.428 . . . . 3.27 111.504 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -74.36 -35.54 63.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.049 0.452 . . . . 0.68 110.073 176.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.405 ' HB3' ' CG2' ' A' ' 114' ' ' VAL . . . -81.39 -37.09 28.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 1.18 112.017 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 110.297 -1.121 . . . . 1.62 110.297 -169.265 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 16.9 p90 . . . . . 0 C--O 1.235 0.302 0 CA-C-O 120.875 0.369 . . . . 2.09 110.178 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HZ1' ' A' ' 30' ' ' LYS . 97.9 mttt -121.39 161.59 21.86 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.324 -0.235 . . . . 3.54 110.396 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.666 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 52.6 t80 -54.22 -52.6 60.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 2.56 111.598 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.476 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 68.4 mm-40 -73.88 -0.13 15.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.621 0.6 . . . . 4.16 112.621 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -91.99 -20.47 21.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 2.57 110.407 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.35 138.69 74.89 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.556 -0.905 . . . . 1.31 108.556 176.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -45.31 112.96 0.44 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.15 2.567 . . . . 0.7 112.697 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.02 67.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.732 -0.667 . . . . 1.23 111.471 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -65.25 -35.33 80.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 122.238 1.018 . . . . 1.37 109.283 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.643 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 84.8 t80 -83.92 -28.43 27.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.119 -1.4 . . . . 1.08 110.617 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 53.1 mtp180 -70.0 -18.73 63.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.556 0.693 . . . . 2.1 109.732 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -21.18 63.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.62 -1.173 . . . . 1.02 110.206 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.3 mt -94.05 -26.44 16.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.925 -0.58 . . . . 1.49 110.636 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.8 mtt -62.22 124.93 84.31 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 1.65 110.462 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.38 151.27 65.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.226 1.951 . . . . 1.12 112.529 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' A' ' 18' ' ' ALA . 88.0 Cg_exo -48.89 -50.09 13.5 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 122.851 2.367 . . . . 1.3 112.197 -177.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -77.21 42.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.924 -1.035 . . . . 2.26 111.355 -178.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.427 ' H ' ' C ' ' A' ' 16' ' ' PRO . . . -156.79 -38.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.022 -0.99 . . . . 1.39 108.596 175.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -67.03 -32.09 73.07 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.34 -0.845 . . . . 2.54 110.289 173.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -50.29 -46.91 55.57 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.766 0.666 . . . . 1.06 111.477 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.647 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 43.1 t80 -58.43 -61.47 2.56 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 119.175 -0.44 . . . . 0.73 111.589 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.33 -9.4 58.66 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 119.614 1.097 . . . . 1.75 112.254 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.61 -40.23 80.51 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.683 -0.488 . . . . 2.56 109.683 163.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -72.34 -54.1 10.44 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.628 -0.714 . . . . 1.84 110.881 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.624 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.6 mm? -53.94 126.58 22.95 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.434 0.635 . . . . 1.7 110.461 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -112.39 -73.59 0.66 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.027 -0.988 . . . . 2.16 111.17 -170.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 3.4 p-10 -140.03 -86.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.587 0.217 . . . . 2.39 111.587 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.458 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -63.01 -14.17 51.7 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 121.475 -0.393 . . . . 1.47 112.708 -178.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.93 -38.07 87.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.286 0.565 . . . . 2.25 109.802 176.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.407 ' HZ1' ' HA ' ' A' ' 2' ' ' LYS . 76.5 mttt -77.26 -9.31 58.72 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.443 0.64 . . . . 1.89 110.732 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.406 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 91.3 m -63.78 -45.81 88.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.32 -0.854 . . . . 1.37 109.801 172.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.97 -32.77 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 114.837 -1.074 . . . . 0.85 110.406 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.441 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.5 mm? -53.55 -52.92 58.16 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.245 -0.434 . . . . 1.65 111.443 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 7.7 ptpp? -66.78 -23.68 66.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.553 -0.294 . . . . 2.89 111.573 -175.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.9 mm-40 -72.53 -31.09 65.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.578 0.228 . . . . 1.96 110.796 176.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.8 t -74.06 -53.06 18.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.966 0.888 . . . . 0.98 109.758 174.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 28.3 m-85 -56.47 -42.13 77.71 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 114.628 1.344 . . . . 1.08 114.628 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.496 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 9.5 mtmp? -79.94 7.53 8.72 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.129 -0.628 . . . . 2.71 111.197 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -103.1 -77.18 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.513 -0.767 . . . . 1.57 109.531 170.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.55 -157.48 1.03 Allowed Glycine 0 CA--C 1.523 0.566 0 C-N-CA 120.902 -0.666 . . . . 1.54 112.964 -174.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -91.31 139.69 10.64 Favored 'Cis proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.287 -1.13 . . . . 1.99 111.288 -8.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -110.07 112.24 24.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.5 0.667 . . . . 1.72 111.281 -173.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -72.71 -14.28 61.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.529 -1.214 . . . . 4.11 111.808 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.449 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -145.19 151.78 38.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.814 0.34 . . . . 1.53 111.524 -173.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.7 m -77.97 64.38 3.17 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.919 0.866 . . . . 1.72 110.122 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.449 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 28.0 tt0 -156.72 -43.54 0.07 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.9 -1.045 . . . . 2.24 108.724 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -59.0 -38.89 80.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.416 -0.811 . . . . 2.26 111.012 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 m -65.28 -39.56 92.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 1.69 110.02 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.0 -42.1 91.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 1.2 110.335 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.37 -49.62 73.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.788 -1.097 . . . . 1.29 111.307 175.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.97 88.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.431 0.634 . . . . 1.21 110.294 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.438 HD22 HD11 ' A' ' 33' ' ' LEU . 36.6 mt -65.49 -41.53 93.16 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.16 -0.927 . . . . 1.13 111.053 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.35 -38.22 83.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.898 0.38 . . . . 1.87 111.072 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -68.38 -40.86 81.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.599 -0.728 . . . . 3.57 111.387 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.862 0.363 . . . . 2.01 111.533 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -138.68 99.58 8.46 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.339 -0.615 . . . . 1.68 109.339 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -46.3 -52.28 7.48 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.992 3.128 . . . . 0.84 112.991 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.87 -34.56 78.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.94 -1.027 . . . . 2.45 112.233 -178.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.8 mt -74.89 -39.67 61.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.103 -1.039 . . . . 2.03 109.774 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.03 -39.0 96.08 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 114.76 -1.109 . . . . 0.41 111.549 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.3 89.3 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.125 -0.324 . . . . 1.19 110.125 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -56.58 -57.38 12.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.581 -0.736 . . . . 2.7 110.761 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -65.74 -30.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 1.12 111.043 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.408 ' O ' ' HD2' ' A' ' 67' ' ' HIS . 41.7 tt0 -63.99 -60.46 3.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.399 -0.364 . . . . 1.7 110.964 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.39 -32.58 73.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.593 0.711 . . . . 4.35 110.213 -174.602 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.491 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 8.4 tp -67.84 -45.57 74.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.993 -1.003 . . . . 2.09 111.818 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.408 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -79.99 -18.99 48.85 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.062 -0.718 . . . . 3.07 109.062 -175.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.99 85.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.004 -0.998 . . . . 1.26 110.521 173.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.493 ' O ' ' HE2' ' A' ' 73' ' ' LYS . 30.8 mtm -59.47 -45.58 91.24 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.443 0.639 . . . . 1.21 109.629 175.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.8 t -56.04 -40.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.028 -0.987 . . . . 0.79 110.548 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -67.27 -31.71 72.22 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.844 -0.616 . . . . 2.03 111.83 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.6 m -55.35 -41.93 73.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.009 0.433 . . . . 1.66 110.713 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.493 ' HE2' ' O ' ' A' ' 69' ' ' MET . 3.0 mmtt -71.06 -43.59 67.5 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 2.14 110.182 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 74.1 mt -70.63 -21.14 22.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.4 0.619 . . . . 1.1 110.898 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.74 43.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.744 0.783 . . . . 1.18 109.547 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 0.26 57.15 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.538 -1.21 . . . . 1.11 110.324 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.427 HD11 ' CG ' ' A' ' 135' ' ' GLN . 9.1 tp -93.07 133.04 36.63 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 1.34 109.818 -175.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.16 158.86 50.35 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.998 -0.62 . . . . 0.76 111.852 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.71 -34.99 22.38 Favored 'Trans proline' 0 N--CA 1.474 0.359 0 C-N-CA 123.611 2.874 . . . . 1.89 113.798 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -65.33 -55.0 20.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.06 0.457 . . . . 2.52 110.187 -178.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.3 -29.54 38.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.628 -0.714 . . . . 1.13 111.168 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.8 ttmt -56.5 -45.9 80.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.963 -0.562 . . . . 2.52 111.017 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.4 -42.07 98.79 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.792 -0.718 . . . . 0.46 111.928 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 16.9 t80 -66.06 -44.62 84.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.196 . . . . 2.04 111.12 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.1 79.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.389 -0.369 . . . . 1.07 111.403 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 26.1 mt-10 -72.35 -35.31 68.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.813 -0.355 . . . . 1.96 110.744 -178.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -66.52 -50.31 63.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.238 -0.437 . . . . 2.74 110.402 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.5 p -67.14 -38.92 86.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 0.65 111.485 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.1 mp -57.23 -39.72 69.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.334 -0.394 . . . . 1.79 111.205 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 63.6 mt-10 -72.31 -30.61 64.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.694 0.283 . . . . 2.82 111.064 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.2 mt -74.59 -55.42 12.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.75 0.31 . . . . 1.2 110.614 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.2 -50.24 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.944 -0.571 . . . . 1.23 111.22 -178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.99 -12.96 61.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.944 -0.571 . . . . 5.02 110.971 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.73 -28.89 56.22 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.446 -0.662 . . . . 0.72 111.446 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -62.7 -49.89 81.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.031 0.443 . . . . 1.23 110.628 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.1 OUTLIER -83.1 4.08 27.9 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.258 -0.428 . . . . 3.16 110.611 177.674 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.693 ' HA ' ' CD2' ' A' ' 100' ' ' TYR . . . -89.08 -33.95 16.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.175 -0.466 . . . . 1.33 110.03 172.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.41 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 5.7 ptp180 -86.85 5.46 36.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.407 -0.59 . . . . 3.64 109.407 174.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.448 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -85.33 -37.72 19.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.304 -0.862 . . . . 1.28 109.323 163.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.639 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 26.8 m-85 -57.36 -40.89 79.03 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.273 0.559 . . . . 1.78 111.201 -176.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.0 p -66.39 -8.31 24.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.055 -0.975 . . . . 1.51 112.687 -172.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 96.57 2.49 60.04 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.665 -0.778 . . . . 1.16 111.265 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -95.43 171.01 8.96 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.356 -0.609 . . . . 2.22 109.356 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -138.66 110.07 8.02 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 116.627 -0.26 . . . . 1.75 110.873 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.41 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 19.5 Cg_endo -61.72 143.22 96.15 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.284 1.989 . . . . 0.71 111.002 173.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.455 ' O ' HD11 ' A' ' 110' ' ' LEU . 48.3 p -75.97 165.27 25.22 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.669 -0.493 . . . . 2.17 109.669 178.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -64.18 -22.39 66.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.861 -0.736 . . . . 3.31 109.972 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 111' ' ' LYS . 38.2 m-20 -72.83 -35.68 67.33 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.23 -0.441 . . . . 2.24 110.365 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -60.51 -42.3 96.11 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.253 -0.647 . . . . 1.73 109.253 173.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.455 HD11 ' O ' ' A' ' 106' ' ' THR . 7.1 mp -65.23 -46.73 79.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 114.987 -1.006 . . . . 1.56 110.704 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 108' ' ' ASP . 50.1 mtpt -55.47 -48.24 74.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.347 -0.388 . . . . 2.31 110.558 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -62.37 -42.38 99.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 1.19 111.455 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.1 p -62.02 -38.59 89.25 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.312 0.486 . . . . 1.84 112.312 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.423 ' CG2' ' HB3' ' A' ' 152' ' ' ALA . 3.7 m -83.21 -23.39 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 122.031 0.92 . . . . 0.66 109.454 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -68.44 -48.74 63.78 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.451 -1.249 . . . . 2.26 111.185 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.539 ' O ' HD21 ' A' ' 120' ' ' LEU . 7.8 mm-40 -65.21 -35.91 82.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 2.27 110.829 -177.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.2 m -68.12 -26.86 35.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.662 -0.415 . . . . 0.91 110.269 175.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.545 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 73.8 mt -73.44 -37.73 65.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.537 -0.542 . . . . 1.75 109.537 171.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.5 ttpt -57.11 -46.41 82.64 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 109.197 -0.668 . . . . 1.51 109.197 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.539 HD21 ' O ' ' A' ' 116' ' ' GLU . 4.3 mm? -63.21 -55.36 25.67 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.496 -0.774 . . . . 1.68 111.68 170.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.667 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 17.5 t80 -67.86 -36.04 79.6 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 119.626 -0.83 . . . . 2.2 111.936 -166.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -64.11 -25.07 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.668 0.271 . . . . 2.44 111.464 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -93.45 -5.14 49.92 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.633 0.605 . . . . 1.16 112.633 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.474 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 51.5 mtm -74.7 157.39 35.37 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.1 -0.64 . . . . 1.15 111.21 -178.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 3.6 m -59.78 151.79 24.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.167 -0.469 . . . . 1.57 110.134 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -61.38 -40.71 95.33 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.726 -0.389 . . . . 2.21 110.757 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.96 74.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.381 . . . . 1.18 110.683 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.66 -36.84 67.46 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 0.35 111.558 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 124' ' ' MET . 96.6 mttt -66.08 -43.95 85.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.13 0.49 . . . . 1.84 110.391 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.4 -35.92 81.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 1.15 111.346 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.474 ' OD1' ' HD2' ' A' ' 134' ' ' LYS . 35.9 t70 -74.71 -27.97 60.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.268 0.556 . . . . 0.55 110.069 -176.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.79 -30.63 71.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.078 -0.51 . . . . 0.49 110.158 171.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.436 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -70.21 -26.02 74.82 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.27 113.929 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.474 ' HD2' ' OD1' ' A' ' 131' ' ' ASP . 15.1 ptpt -85.86 -32.12 21.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.256 0.55 . . . . 2.95 111.235 -178.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.438 ' HA ' ' NE2' ' A' ' 135' ' ' GLN . 6.7 mm100 -88.17 -41.78 12.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.676 -0.693 . . . . 1.83 110.658 -178.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.624 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 31.1 m-85 -124.37 75.63 61.51 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-O 120.876 0.369 . . . . 0.91 110.465 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -62.68 -41.73 29.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.166 2.578 . . . . 1.06 112.713 -174.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.659 ' HD2' ' CD1' ' A' ' 138' ' ' PHE . 46.2 t80 -58.29 -44.8 88.67 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.151 -0.477 . . . . 2.9 111.1 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.79 -42.27 50.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.422 -0.353 . . . . 1.67 110.878 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.436 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.63 -40.75 84.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 1.04 109.94 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 85.9 tttt -46.83 -68.43 0.19 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.947 -1.024 . . . . 3.06 111.26 172.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.0 m -62.83 -28.55 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.646 -0.706 . . . . 0.5 112.637 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -73.09 -49.75 26.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.017 -0.673 . . . . 0.92 110.633 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.4 -32.54 66.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.596 -0.275 . . . . 2.58 111.463 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.4 t -71.4 -26.68 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.198 0.523 . . . . 1.81 110.52 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.05 7.02 56.66 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.604 -0.808 . . . . 1.41 112.226 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -63.35 -48.95 75.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.911 0.386 . . . . 2.46 110.554 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.0 -34.97 71.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 1.07 110.091 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.545 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -58.58 -54.25 49.15 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.57 -0.741 . . . . 1.12 110.466 177.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.34 -41.76 63.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 3.27 111.374 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 151' ' ' PHE . 36.9 t80 -55.7 -46.2 77.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.68 111.269 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.423 ' HB3' ' CG2' ' A' ' 114' ' ' VAL . . . -86.17 -10.0 55.55 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.925 0.713 . . . . 1.18 112.925 -176.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 C-N-CA 120.15 -1.024 . . . . 1.62 110.845 -172.783 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 0.717 ' HA ' ' OE1' ' A' ' 4' ' ' GLU . 50.9 t80 . . . . . 0 C--O 1.223 -0.339 0 CA-C-O 121.286 0.565 . . . . 2.09 111.514 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.567 ' HB3' ' HZ2' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -102.57 38.67 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.688 . . . . 3.54 109.527 178.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.663 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 0.4 OUTLIER 58.09 22.2 8.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.04 -1.467 . . . . 2.56 107.04 -159.117 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.717 ' OE1' ' HA ' ' A' ' 1' ' ' PHE . 12.0 mm-40 40.92 28.48 0.05 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 112.623 -2.08 . . . . 4.16 115.076 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 43.08 34.19 0.62 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.209 0.528 . . . . 2.57 110.733 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 99.7 mt -53.29 134.44 51.57 Favored Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 115.887 -0.597 . . . . 1.31 111.405 -174.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -36.23 113.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.035 3.157 . . . . 0.7 112.694 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.07 -15.82 57.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.56 -0.746 . . . . 1.23 111.227 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.97 -34.41 77.7 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.243 1.02 . . . . 1.37 108.903 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.621 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 29.6 t80 -88.81 -33.09 17.54 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 113.58 -1.646 . . . . 1.08 111.122 -175.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.439 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 32.3 mtm180 -68.61 -27.79 66.34 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.25 -0.648 . . . . 2.1 109.25 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.39 -36.15 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.16 -0.927 . . . . 1.02 110.594 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.66 -36.06 60.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.627 -0.715 . . . . 1.49 110.356 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 71.5 mtm -67.74 133.53 92.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.872 -0.603 . . . . 1.65 111.41 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.446 ' HB2' ' OE2' ' A' ' 17' ' ' GLU . 72.2 Cg_endo -76.99 163.83 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.577 2.185 . . . . 1.12 112.075 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.59 -44.23 17.49 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 123.085 2.523 . . . . 1.3 113.229 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 15' ' ' PRO . 2.1 pm0 -71.79 9.23 0.94 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.752 0.649 . . . . 2.26 112.752 -176.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.06 -21.76 4.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.913 0.387 . . . . 1.39 110.736 172.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 63.9 mtp180 -91.89 -44.48 8.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.043 -0.526 . . . . 2.54 110.625 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 13.3 t70 -50.15 -50.9 47.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.544 -0.753 . . . . 1.06 111.253 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.649 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 41.1 t80 -52.56 -62.14 1.83 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.73 111.799 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 1' ' ' PHE . 13.0 mt -74.59 -6.95 51.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 118.667 0.667 . . . . 1.75 111.05 -175.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.431 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 8.3 tp-100 -75.36 -43.27 51.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.17 0.51 . . . . 2.56 110.739 163.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -64.97 -47.63 76.9 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.583 -0.735 . . . . 1.84 111.842 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.553 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.7 mm? -53.34 132.72 39.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.48 0.657 . . . . 1.7 110.435 177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -114.1 -72.23 0.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.984 -1.007 . . . . 2.16 112.083 -173.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -140.11 -82.95 0.25 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.624 -0.43 . . . . 2.39 111.802 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.81 -29.89 71.47 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 121.464 -0.398 . . . . 1.47 113.395 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.43 -6.83 50.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.812 0.339 . . . . 2.25 111.12 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.523 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 92.4 mttt -89.48 -24.81 21.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.228 0.537 . . . . 1.89 109.864 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.5 m -62.34 -33.68 75.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.309 -0.86 . . . . 1.37 111.008 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.676 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 4.4 p -75.38 -32.11 25.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.537 -0.301 . . . . 0.85 111.713 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.435 HD11 ' CE2' ' A' ' 37' ' ' PHE . 4.0 mm? -49.88 -51.87 37.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.867 0.321 . . . . 1.65 111.867 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -64.25 -33.04 74.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.758 0.313 . . . . 2.89 110.832 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -65.86 -24.7 66.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.509 . . . . 1.96 110.735 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -91.98 -44.43 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.992 -0.549 . . . . 0.98 110.587 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.435 ' CE2' HD11 ' A' ' 33' ' ' LEU . 18.9 m-85 -55.14 -34.49 63.81 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.748 0.647 . . . . 1.08 112.748 173.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -93.15 7.64 43.42 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.087 -0.645 . . . . 2.71 110.921 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.57 12.23 22.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.975 -0.557 . . . . 1.57 110.375 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.85 -158.48 19.44 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.88 -0.676 . . . . 1.54 112.181 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.64 163.58 87.93 Favored 'Cis proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.935 -1.277 . . . . 1.99 112.754 0.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.553 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 45.9 m-85 -121.57 134.78 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.186 -0.915 . . . . 1.72 109.599 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -81.02 -12.02 59.44 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.872 -0.604 . . . . 4.11 110.482 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.552 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -161.0 165.03 30.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.703 -0.681 . . . . 1.53 110.191 -178.415 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.9 m -64.62 -29.59 70.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.222 0.326 . . . . 1.72 111.09 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -53.1 -43.85 67.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.086 -0.506 . . . . 2.24 111.402 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.553 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 29.5 mt-10 -59.43 -42.11 91.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.201 -0.454 . . . . 2.26 111.215 177.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.6 t -66.32 -39.62 89.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.32 -0.4 . . . . 1.69 110.158 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.81 -41.98 93.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.54 . . . . 1.2 110.19 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.9 -50.09 74.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.164 -0.926 . . . . 1.29 111.286 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.94 -39.58 74.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 1.21 110.771 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 29.9 mt -69.24 -40.23 78.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.636 -0.711 . . . . 1.13 111.03 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -63.38 -31.16 72.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.774 0.321 . . . . 1.87 111.779 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.82 -38.16 70.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.176 -0.465 . . . . 3.57 111.061 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.676 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 5.2 tppt? -85.8 -56.02 3.69 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.994 0.426 . . . . 2.01 110.835 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.9 m -127.57 90.72 47.63 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.854 -0.612 . . . . 1.68 109.515 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.66 -55.41 3.58 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 124.31 3.34 . . . . 0.84 113.196 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -63.54 -32.96 74.57 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 114.603 -1.18 . . . . 2.45 112.084 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.7 -39.63 66.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.049 0.928 . . . . 2.03 108.759 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.82 88.3 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.124 -1.398 . . . . 0.41 111.436 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.32 -32.24 72.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.817 0.341 . . . . 1.19 110.662 175.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -66.96 -51.87 49.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 2.7 110.908 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.94 -24.23 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 120.851 0.358 . . . . 1.12 110.684 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -65.1 -59.29 4.28 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.257 -0.429 . . . . 1.7 110.792 177.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -34.84 77.63 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.534 0.683 . . . . 4.35 109.444 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.47 ' CD2' ' HB2' ' A' ' 21' ' ' PHE . 18.0 tp -67.62 -30.35 69.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.691 -1.14 . . . . 2.09 110.657 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -83.58 -37.0 23.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 109.083 -0.71 . . . . 3.07 109.083 -177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.92 83.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.039 -0.982 . . . . 1.26 110.354 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.9 mtp -53.6 -57.96 8.88 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.354 0.597 . . . . 1.21 110.363 173.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.9 t -56.07 -44.85 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 114.794 -1.094 . . . . 0.79 110.881 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -64.63 -42.44 95.47 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 116.053 -0.522 . . . . 2.03 111.698 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.9 m -59.21 -35.26 73.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.168 0.509 . . . . 1.66 110.89 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 88.7 mttt -78.1 -46.7 20.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.729 -0.669 . . . . 2.14 110.552 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.2 mt -66.25 -17.22 22.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 121.844 0.83 . . . . 1.1 110.379 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.16 -34.72 56.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.986 -1.006 . . . . 1.18 110.035 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -85.35 -1.32 56.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.811 -1.086 . . . . 1.11 110.17 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.484 HD12 ' HA ' ' A' ' 132' ' ' PHE . 7.8 tp -96.57 138.64 33.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.544 -0.753 . . . . 1.34 110.417 -175.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.56 152.8 52.44 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.934 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -41.15 -44.99 5.42 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 124.392 3.395 . . . . 1.89 114.368 -176.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 1.0 OUTLIER -69.19 -44.31 72.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 2.52 111.239 -175.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.29 -32.52 55.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.553 0.692 . . . . 1.13 109.817 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -52.33 -51.62 57.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.373 -1.285 . . . . 2.52 111.651 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.84 -40.8 95.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.014 -0.612 . . . . 0.46 112.363 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 14.6 t80 -68.98 -44.1 73.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.391 0.139 . . . . 2.04 110.883 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.431 ' O ' HD11 ' A' ' 89' ' ' ILE . . . -58.05 -37.33 74.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.977 0.418 . . . . 1.07 111.046 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 44.2 mt-10 -68.14 -48.33 65.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.059 -0.519 . . . . 1.96 110.279 178.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -66.05 -44.19 85.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.346 0.498 . . . . 2.74 112.346 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 11.8 p -59.79 -45.85 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.86 0.362 . . . . 0.65 110.998 -178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.431 HD11 ' O ' ' A' ' 85' ' ' ALA . 1.6 mp -60.36 -41.88 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.013 -0.539 . . . . 1.79 110.648 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 46.4 mt-10 -64.24 -52.83 56.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.654 0.242 . . . . 2.82 111.654 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 70.6 mt -60.51 -43.85 95.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 120.868 0.366 . . . . 1.2 111.279 -176.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.4 -46.24 73.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.079 0.466 . . . . 1.23 111.17 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -68.65 -25.97 65.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.445 -0.343 . . . . 5.02 111.781 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.64 -36.3 75.7 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.852 -0.69 . . . . 0.72 112.024 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 mm -58.91 -41.32 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.009 0.433 . . . . 1.23 111.145 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.519 ' HB2' ' HZ1' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -96.5 17.88 15.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.117 0.484 . . . . 3.16 110.707 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -102.22 -34.54 9.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.604 -0.725 . . . . 1.33 109.06 169.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.519 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 8.1 ptm180 -83.63 -3.23 57.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 3.64 109.954 174.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.502 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -80.27 -40.08 27.64 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.491 -0.559 . . . . 1.28 109.491 164.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.631 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 2.9 m-85 -68.56 -32.44 72.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.605 -0.725 . . . . 1.78 111.985 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.3 p -65.46 -15.08 62.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 1.51 112.06 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 107.68 10.68 26.42 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 121.11 -0.567 . . . . 1.16 111.816 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 87.5 m-20 -108.53 169.22 8.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.882 -0.414 . . . . 2.22 109.882 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.7 mt-10 -133.15 104.83 12.43 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 121.19 -0.204 . . . . 1.75 111.302 177.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.8 Cg_endo -60.38 139.53 87.08 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 121.744 1.63 . . . . 0.71 110.647 171.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.44 HG23 ' OD2' ' A' ' 109' ' ' ASP . 11.4 t -83.97 176.64 8.72 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.799 -0.445 . . . . 2.17 109.799 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.6 pptp? -63.81 -25.79 68.33 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.511 -0.476 . . . . 3.31 110.644 -176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.87 -35.44 80.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.903 -0.59 . . . . 2.24 110.01 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . 0.44 ' OD2' HG23 ' A' ' 106' ' ' THR . 20.6 m-20 -63.96 -45.69 88.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 1.73 110.587 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.3 mp -66.38 -43.89 84.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 1.56 110.58 178.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.561 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 23.9 ttmm -59.38 -42.95 92.87 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.193 -0.458 . . . . 2.31 110.426 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.498 ' O ' ' HG3' ' A' ' 116' ' ' GLU . . . -68.01 -42.41 80.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.471 -0.332 . . . . 1.19 110.838 177.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.2 t -53.06 -50.26 64.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 1.84 111.096 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.502 ' O ' HD21 ' A' ' 118' ' ' LEU . 3.8 m -77.97 -26.24 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-O 121.534 0.683 . . . . 0.66 109.639 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 62.9 tttm -60.44 -42.33 95.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.368 -0.833 . . . . 2.26 111.074 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 112' ' ' ALA . 29.8 mt-10 -73.39 -37.71 65.88 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.6 -0.44 . . . . 2.27 110.502 -177.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.2 m -66.73 -34.5 70.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.502 -0.479 . . . . 0.91 110.39 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.502 HD21 ' O ' ' A' ' 114' ' ' VAL . 4.0 mm? -71.64 -35.24 70.33 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.062 -0.399 . . . . 1.75 110.225 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -59.31 -40.75 87.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.956 -0.757 . . . . 1.51 108.956 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.41 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -71.9 -53.71 12.3 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.228 -0.896 . . . . 1.68 111.792 172.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.63 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 72.2 t80 -69.53 -37.04 76.95 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 119.916 -0.714 . . . . 2.2 111.914 -165.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -68.66 -28.57 67.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 2.44 110.987 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.32 56.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 1.16 112.136 -176.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 36.6 mtm -74.96 160.15 30.93 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.546 -0.461 . . . . 1.15 111.342 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.0 t -60.05 137.05 58.18 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.011 -0.737 . . . . 1.57 109.011 172.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.5 -39.51 73.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.561 -0.745 . . . . 2.21 111.691 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.59 87.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 1.18 110.606 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.78 66.33 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.639 -0.71 . . . . 0.35 111.46 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -64.96 -45.98 83.47 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.378 0.608 . . . . 1.84 109.714 176.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.59 78.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.387 -0.824 . . . . 1.15 110.529 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.427 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 38.2 t70 -74.16 -33.91 63.64 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.381 -0.6 . . . . 0.55 109.381 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' A' ' 77' ' ' LEU . 82.6 t80 -62.31 -32.39 73.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.735 -0.666 . . . . 0.49 110.343 171.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -70.39 -7.63 60.94 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.27 112.945 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 79.2 mttt -88.94 -43.45 11.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.361 0.601 . . . . 2.95 109.596 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.514 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.7 mp0 -86.34 -35.75 19.67 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.17 -0.923 . . . . 1.83 111.304 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.613 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 49.5 m-85 -133.95 74.8 68.11 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.218 0.532 . . . . 0.91 110.441 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.92 -31.74 66.68 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 123.243 2.628 . . . . 1.06 112.926 -174.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.61 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 34.9 m-85 -61.88 -44.82 96.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.065 0.394 . . . . 2.9 112.065 -177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.6 mt -72.27 -43.72 63.88 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.506 -0.478 . . . . 1.67 110.191 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.25 -31.51 67.48 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.481 0.657 . . . . 1.04 110.451 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.523 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 25.4 ttmm -61.54 -76.94 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.094 -0.957 . . . . 3.06 111.664 173.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.9 -24.35 35.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.173 -0.921 . . . . 0.5 112.636 -169.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -70.82 -41.62 71.32 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.799 -0.36 . . . . 0.92 110.47 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -81.6 -25.22 35.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.455 . . . . 2.58 110.96 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.8 m -69.67 -8.72 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.03 0.443 . . . . 1.81 110.513 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 88.64 -4.06 85.06 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.901 -0.591 . . . . 1.41 113.099 175.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -69.12 -53.94 17.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.731 0.301 . . . . 2.46 111.193 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.0 -39.64 93.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.409 -0.36 . . . . 1.07 110.603 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.44 -42.76 88.07 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.158 -0.474 . . . . 1.12 110.512 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -62.5 -41.7 99.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.826 0.346 . . . . 3.27 110.372 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.667 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 22.6 t80 -62.71 -34.86 78.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.942 -0.572 . . . . 0.68 110.332 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' A' ' 115' ' ' LYS . . . -79.48 -34.24 41.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 1.18 111.946 -178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 111.22 -0.752 . . . . 1.62 111.22 -174.923 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.605 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 18.6 p90 . . . . . 0 C--O 1.235 0.318 0 CA-C-O 121.142 0.496 . . . . 2.09 111.435 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.523 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 68.5 mttm -118.09 157.0 27.67 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.745 -0.662 . . . . 3.54 109.733 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.664 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 48.9 t80 -66.64 -18.08 65.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.464 0.649 . . . . 2.56 109.736 175.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -84.24 -14.65 49.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.313 -0.858 . . . . 4.16 110.847 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 5.5 m-20 -93.66 -6.03 47.28 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.294 0.569 . . . . 2.57 110.414 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.1 mt -85.49 135.41 38.59 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.325 -0.852 . . . . 1.31 108.952 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -46.24 114.26 0.81 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.199 2.599 . . . . 0.7 112.583 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.97 67.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 1.23 111.713 -176.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -63.86 -36.32 83.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.897 0.856 . . . . 1.37 109.556 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.661 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 74.0 t80 -88.27 -19.03 27.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.097 -1.411 . . . . 1.08 110.618 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -74.53 -25.49 59.37 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.502 0.668 . . . . 2.1 109.557 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.602 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 27.5 t70 -67.16 -25.16 66.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.066 -0.97 . . . . 1.02 110.36 173.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 98.2 mt -87.3 7.68 27.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 1.49 111.013 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.522 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 67.1 mtt -93.79 122.06 63.09 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.452 -0.34 . . . . 1.65 110.143 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.2 150.35 84.96 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.286 1.991 . . . . 1.12 111.159 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -45.87 -45.19 17.53 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.009 2.473 . . . . 1.3 113.246 -172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' OE2' ' HE1' ' A' ' 69' ' ' MET . 3.4 mm-40 -57.89 -50.43 73.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.952 0.406 . . . . 2.26 111.134 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.7 -37.08 70.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 1.39 111.836 -174.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' A' ' 14' ' ' MET . 14.0 ptm180 -76.91 -29.17 55.6 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 121.019 -0.273 . . . . 2.54 111.071 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.477 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 27.9 t70 -56.39 -45.38 80.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.712 0.292 . . . . 1.06 110.553 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.643 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 50.2 t80 -55.58 -60.35 3.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.07 -0.514 . . . . 0.73 111.823 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.496 ' HG ' ' HH ' ' A' ' 100' ' ' TYR . 23.1 mt -73.45 -8.11 54.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 119.791 1.178 . . . . 1.75 112.045 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.477 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 28.1 tt0 -69.07 -38.7 79.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.086 0.469 . . . . 2.56 109.875 163.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -72.15 -54.23 10.32 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.808 -0.633 . . . . 1.84 110.349 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -54.12 130.62 38.86 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.227 -0.897 . . . . 1.7 111.115 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 m -129.96 -82.34 0.55 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.508 -0.769 . . . . 2.16 110.994 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.54 154.59 43.03 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.546 -0.538 . . . . 2.39 109.546 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -45.76 3.52 Favored Glycine 0 C--N 1.322 -0.225 0 C-N-CA 120.462 -0.875 . . . . 1.47 111.694 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.418 ' O ' HD21 ' A' ' 33' ' ' LEU . 3.5 m-20 -67.51 -29.74 69.23 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 2.25 109.534 175.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HG3' ' CE1' ' A' ' 1' ' ' PHE . 1.5 mptm? -62.44 -18.07 60.85 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.008 -0.542 . . . . 1.89 110.361 176.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.4 m -74.4 -45.48 46.45 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.757 -0.656 . . . . 1.37 110.318 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.748 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 2.3 p -73.17 -41.77 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 120.281 -0.567 . . . . 0.85 110.917 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.545 HD13 ' CE1' ' A' ' 37' ' ' PHE . 3.8 mm? -55.94 -35.57 66.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.623 0.249 . . . . 1.65 110.837 175.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.441 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 64.2 tttm -70.27 -27.49 64.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.396 -0.365 . . . . 2.89 111.243 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.26 -28.52 14.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.629 0.252 . . . . 1.96 111.676 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.562 ' O ' ' HA ' ' A' ' 39' ' ' ALA . 74.6 t -83.94 -28.12 7.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.153 0.501 . . . . 0.98 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.62 ' HE2' ' CE1' ' A' ' 37' ' ' PHE . 15.0 m-85 -74.39 -24.94 59.2 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 113.895 1.072 . . . . 1.08 113.895 165.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 71.7 mmtt -75.73 -17.81 59.79 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 106.815 -1.55 . . . . 2.71 106.815 165.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.562 ' HA ' ' O ' ' A' ' 36' ' ' VAL . . . 70.16 -79.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 116.94 2.2 . . . . 1.57 116.94 154.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.79 -72.34 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 118.628 -1.749 . . . . 1.54 114.09 -157.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -88.36 172.28 30.9 Favored 'Cis proline' 0 N--CA 1.461 -0.438 0 N-CA-C 115.081 1.147 . . . . 1.99 115.081 7.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.528 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 15.4 m-85 -100.63 155.79 17.68 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.263 -1.335 . . . . 1.72 110.572 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -101.4 -12.01 18.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.72 -0.673 . . . . 4.11 110.707 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.552 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -157.66 161.84 38.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.598 -0.274 . . . . 1.53 111.365 -177.307 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.9 m -60.03 -35.16 74.5 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 123.223 0.327 . . . . 1.72 111.287 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -49.56 -38.63 31.91 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.998 -0.547 . . . . 2.24 112.135 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' HG3' HD22 ' A' ' 44' ' ' ASN . 28.3 mt-10 -70.25 -31.13 68.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.724 -0.217 . . . . 2.26 111.434 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 t -72.72 -43.08 63.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.56 -0.534 . . . . 1.69 109.56 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.39 -43.21 97.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 1.2 109.785 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.9 -48.23 78.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.413 -0.812 . . . . 1.29 111.139 173.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.92 86.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.448 0.642 . . . . 1.21 110.463 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.0 mt -68.76 -40.17 79.89 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.957 -1.02 . . . . 1.13 111.215 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -66.32 -22.22 66.27 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.562 -0.455 . . . . 1.87 111.218 177.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -84.4 -33.05 23.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 3.57 110.758 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.748 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 22.8 tptp -90.57 -60.77 1.83 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.886 -0.597 . . . . 2.01 110.769 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.5 p -127.96 85.88 59.54 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 115.87 -0.604 . . . . 1.68 109.713 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.32 -60.02 0.93 Allowed 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 124.051 3.167 . . . . 0.84 113.747 -168.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.33 -26.06 68.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.649 -1.16 . . . . 2.45 111.608 -176.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.484 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 52.7 tp -75.19 -39.48 60.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.655 0.741 . . . . 2.03 109.546 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.18 -32.09 81.31 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.91 -1.041 . . . . 0.41 111.3 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -34.84 78.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.705 -0.247 . . . . 1.19 110.606 174.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 57.8 mttp -61.53 -45.08 95.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.086 0.47 . . . . 2.7 110.072 175.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.39 -38.51 69.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.859 -0.61 . . . . 1.12 110.763 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.06 -44.01 90.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.486 . . . . 1.7 111.231 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -66.01 -40.55 91.21 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.079 -0.711 . . . . 4.35 109.079 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 21' ' ' PHE . 61.5 tp -65.25 -35.25 80.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.284 -0.871 . . . . 2.09 110.722 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -73.64 -39.63 64.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.46 -0.941 . . . . 3.07 108.46 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.63 87.14 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.892 -1.049 . . . . 1.26 110.624 176.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.416 ' HE1' ' OE2' ' A' ' 17' ' ' GLU . 21.5 mtp -61.64 -57.61 11.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.306 0.574 . . . . 1.21 110.71 176.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 87.4 t -58.69 -43.7 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 115.515 -0.766 . . . . 0.79 110.708 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -64.51 -34.29 77.87 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.931 -0.577 . . . . 2.03 111.563 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 38.2 t -57.98 -48.9 78.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.084 0.469 . . . . 1.66 110.287 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.516 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 62.2 mttm -66.16 -47.73 73.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.559 -0.746 . . . . 2.14 110.529 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.64 -24.51 33.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.244 0.545 . . . . 1.1 111.408 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.92 64.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.468 0.652 . . . . 1.18 110.495 174.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.39 -2.54 58.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.191 -0.913 . . . . 1.11 110.456 -178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.4 tp -95.45 130.51 42.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.686 -0.688 . . . . 1.34 110.041 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.77 152.26 46.02 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.837 -0.696 . . . . 0.76 112.11 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -40.21 -43.28 3.79 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 124.243 3.295 . . . . 1.89 114.397 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -63.9 -44.63 92.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.886 0.374 . . . . 2.52 111.159 -176.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -86.07 -30.82 22.32 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.498 -0.481 . . . . 1.13 110.411 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -57.89 -46.34 85.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.485 -0.779 . . . . 2.52 110.758 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.28 -41.06 94.78 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.885 -0.674 . . . . 0.46 112.067 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.567 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.8 t80 -69.52 -46.38 66.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.981 -0.11 . . . . 2.04 110.967 176.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.93 -47.16 78.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.118 0.485 . . . . 1.07 111.267 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.627 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.3 mt-10 -65.73 -39.66 91.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.795 -0.638 . . . . 1.96 110.704 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -74.3 -42.11 60.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.516 -0.311 . . . . 2.74 111.487 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.1 p -64.37 -39.36 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.912 0.387 . . . . 0.65 110.168 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.33 -39.92 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.773 -0.649 . . . . 1.79 110.215 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.627 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.5 mt-10 -66.48 -45.69 78.82 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 111.465 0.172 . . . . 2.82 111.465 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.9 mt -61.97 -43.15 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.959 0.409 . . . . 1.2 110.546 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.04 -37.94 75.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.237 -0.438 . . . . 1.23 110.015 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -60.05 -43.01 95.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 5.02 110.964 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -63.74 -30.15 76.82 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 121.088 -0.577 . . . . 0.72 112.496 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -68.0 -46.13 82.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.772 0.32 . . . . 1.23 111.35 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 9.9 mptt -82.4 -17.78 44.25 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.576 -0.449 . . . . 3.16 110.199 177.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.442 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . . . -61.86 -37.9 86.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.805 0.336 . . . . 1.33 110.446 171.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 11.7 ptm180 -89.92 7.81 35.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.086 -0.506 . . . . 3.64 110.564 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.419 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 6.5 m-85 -95.38 -41.15 9.15 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.65 -0.871 . . . . 1.28 108.65 162.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.665 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 28.5 m-85 -61.98 -34.72 76.67 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.675 -0.693 . . . . 1.78 111.342 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.3 p -73.56 1.62 9.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.209 -0.45 . . . . 1.51 112.179 -178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.408 ' HA3' ' HE2' ' A' ' 34' ' ' LYS . . . 89.16 6.41 71.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.093 -0.575 . . . . 1.16 112.356 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 80.4 m-20 -96.47 -176.8 3.74 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.049 -0.352 . . . . 2.22 110.049 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.411 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.7 mt-10 -147.3 109.3 3.92 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.606 -0.27 . . . . 1.75 110.997 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 26.2 Cg_endo -64.14 157.31 54.28 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.823 2.349 . . . . 0.71 112.162 174.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 74.4 p -81.31 171.4 14.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.753 -0.462 . . . . 2.17 109.753 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.96 -26.37 68.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.26 -0.644 . . . . 3.31 109.26 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -67.78 -39.16 84.12 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.266 -0.879 . . . . 2.24 110.611 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -59.39 -41.65 89.86 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.177 0.513 . . . . 1.73 110.448 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.96 -45.03 71.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 1.56 110.669 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 28.8 mtpp -57.63 -48.25 79.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.216 -0.447 . . . . 2.31 110.56 177.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 1.19 110.989 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.1 t -54.46 -49.63 69.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 1.84 111.095 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.1 m -81.44 -22.58 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.765 0.793 . . . . 0.66 109.951 -174.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.532 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 46.8 tttm -67.98 -45.68 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.784 -1.098 . . . . 2.26 111.138 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 15.1 mm-40 -70.69 -34.05 71.56 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.623 -0.431 . . . . 2.27 110.656 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 m -65.0 -31.89 55.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.616 -0.433 . . . . 0.91 110.391 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -73.05 -36.27 66.86 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.051 -0.352 . . . . 1.75 110.051 175.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.2 ttmm -59.5 -48.02 83.26 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.026 -0.731 . . . . 1.51 109.026 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 11.0 mp -68.54 -45.51 71.96 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.876 -1.056 . . . . 1.68 111.768 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.67 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 10.4 t80 -69.52 -37.04 76.96 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.274 -0.571 . . . . 2.2 111.643 -170.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -65.16 -27.78 68.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 2.44 111.395 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.41 -6.86 59.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.089 -0.505 . . . . 1.16 112.055 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.6 mtm -76.4 153.95 35.27 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 1.15 110.382 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -65.8 150.25 48.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.64 -0.255 . . . . 1.57 110.559 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -54.93 -46.56 74.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.217 0.451 . . . . 2.21 112.217 -171.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.31 -32.97 70.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 1.18 110.926 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.14 -34.16 55.73 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.881 -0.6 . . . . 0.35 111.788 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -64.54 -45.88 85.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.076 0.465 . . . . 1.84 110.359 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.59 -28.19 65.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 1.15 110.86 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.441 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 15.8 t70 -77.31 -35.34 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.505 -0.554 . . . . 0.55 109.505 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -60.57 -31.02 70.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.745 -0.661 . . . . 0.49 110.297 172.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.76 -5.63 69.77 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.098 -0.572 . . . . 0.27 113.248 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.441 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 77.6 mttt -94.74 -42.06 8.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.783 0.802 . . . . 2.95 109.485 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.516 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.9 mp0 -80.96 -40.28 24.72 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.769 -1.105 . . . . 1.83 110.968 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.629 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 45.1 m-85 -130.87 72.88 81.63 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.052 0.453 . . . . 0.91 110.713 176.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -65.47 -32.48 49.38 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.957 2.438 . . . . 1.06 112.964 -176.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.645 ' HD2' ' CD1' ' A' ' 138' ' ' PHE . 44.2 t80 -60.45 -41.77 94.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.916 0.389 . . . . 2.9 110.554 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.1 mt -77.62 -42.84 33.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.245 -0.434 . . . . 1.67 110.533 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.16 -34.58 72.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.058 0.456 . . . . 1.04 110.215 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.7 tttp -52.91 -70.85 0.08 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.223 -0.899 . . . . 3.06 111.477 171.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 3.4 m -62.5 -30.41 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.165 -0.925 . . . . 0.5 112.955 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -67.1 -47.89 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.134 -0.626 . . . . 0.92 110.216 -179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -72.19 -38.59 69.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 2.58 111.353 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 31.2 t -70.77 -20.68 62.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 1.81 110.705 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 96.66 2.14 60.02 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.751 -0.738 . . . . 1.41 112.372 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.602 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 44.3 tptt -56.98 -46.72 82.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.829 0.347 . . . . 2.46 110.853 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -77.89 -36.94 49.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.141 0.496 . . . . 1.07 110.34 177.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -57.69 -46.95 83.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.533 -0.758 . . . . 1.12 111.758 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -65.47 -35.49 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 3.27 110.851 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -64.07 -35.37 80.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.304 0.573 . . . . 0.68 109.872 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -78.69 -22.88 46.03 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.662 -0.699 . . . . 1.18 111.683 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.467 0 N-CA-C 111.277 -0.729 . . . . 1.62 111.277 -174.79 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 7.8 p90 . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.11 0.481 . . . . 2.09 110.541 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -120.44 139.33 52.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.177 -0.465 . . . . 3.54 109.922 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.66 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 86.3 t80 -65.53 -30.32 71.06 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.409 -0.589 . . . . 2.56 109.409 175.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -74.9 -19.35 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 4.16 110.698 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -89.96 -13.13 36.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.166 0.508 . . . . 2.57 110.0 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 70.8 mt -77.52 129.78 76.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 109.079 -0.712 . . . . 1.31 109.079 175.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.84 113.66 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.336 2.691 . . . . 0.7 112.379 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.36 65.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.711 -0.677 . . . . 1.23 111.686 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.87 -35.57 76.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.745 0.783 . . . . 1.37 110.263 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.66 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 83.9 t80 -85.56 -29.77 23.88 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 114.585 -1.189 . . . . 1.08 111.064 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -68.45 -27.05 65.84 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.196 -0.668 . . . . 2.1 109.196 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.61 -32.27 71.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.312 -1.313 . . . . 1.02 110.615 174.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -80.57 -31.08 36.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.543 -0.753 . . . . 1.49 111.194 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 73.7 mtm -71.21 134.83 84.89 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 1.65 111.33 -176.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.92 146.02 63.99 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.721 2.281 . . . . 1.12 112.265 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -43.74 -49.35 8.11 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 123.721 2.947 . . . . 1.3 113.813 -173.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.538 ' O ' HD22 ' A' ' 66' ' ' LEU . 1.8 pm0 -57.56 -39.41 76.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.798 0.332 . . . . 2.26 111.811 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -14.51 60.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.774 0.321 . . . . 1.39 111.072 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -91.39 -33.71 15.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 2.54 110.299 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.05 -45.45 32.26 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.579 . . . . 1.06 111.45 178.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.636 ' HE1' ' CE2' ' A' ' 21' ' ' PHE . 38.5 t80 -70.81 1.19 5.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.833 -0.621 . . . . 0.73 112.334 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.524 HD22 ' CE1' ' A' ' 100' ' ' TYR . 71.9 mt -127.83 -16.27 4.72 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.569 -0.707 . . . . 1.75 111.27 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.51 -41.25 98.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.886 -0.783 . . . . 2.56 108.886 164.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -75.58 -51.78 12.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.142 -0.936 . . . . 1.84 112.709 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.454 HD11 HD12 ' A' ' 33' ' ' LEU . 42.0 mt -58.14 142.04 48.43 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.951 0.882 . . . . 1.7 112.79 -172.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.0 p -136.35 -164.55 1.58 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 113.957 -1.474 . . . . 2.16 109.804 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.72 151.52 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.703 0.287 . . . . 2.39 110.432 177.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.43 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . 86.9 -45.56 3.45 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.666 -0.778 . . . . 1.47 112.374 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.67 -37.05 62.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.542 0.687 . . . . 2.25 109.733 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -70.33 -18.02 63.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.633 -0.712 . . . . 1.89 110.194 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 53.1 m -66.89 -40.85 87.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.098 -0.955 . . . . 1.37 111.003 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.428 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 8.3 p -79.23 -27.06 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 0.85 110.631 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.514 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 87.8 mt -56.92 -49.84 74.39 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 111.8 0.296 . . . . 1.65 111.8 177.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.0 pttm -61.09 -25.26 66.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.822 0.344 . . . . 2.89 110.884 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.78 -35.97 75.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.02 0.438 . . . . 1.96 110.438 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.2 t -73.81 -55.89 10.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.575 0.702 . . . . 0.98 110.137 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.514 ' HD2' ' O ' ' A' ' 33' ' ' LEU . 72.9 m-85 -58.27 -46.56 85.81 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 114.763 1.394 . . . . 1.08 114.763 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -77.98 -13.55 59.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 118.501 0.591 . . . . 2.71 111.326 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -79.8 -78.33 0.16 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.325 -0.398 . . . . 1.57 109.997 170.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.94 -157.56 0.37 Allowed Glycine 0 CA--C 1.523 0.54 0 C-N-CA 121.01 -0.614 . . . . 1.54 113.394 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -91.47 172.69 21.91 Favored 'Cis proline' 0 N--CA 1.457 -0.663 0 C-N-CA 124.231 -1.154 . . . . 1.99 111.196 -7.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.49 106.53 8.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.272 0.558 . . . . 1.72 111.671 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -72.71 -18.92 61.49 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.205 -0.907 . . . . 4.11 110.026 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -145.5 157.92 43.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 1.53 109.61 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.5 m -76.13 -27.42 57.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.953 -0.567 . . . . 1.72 111.518 -174.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -58.57 -42.99 89.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.728 0.299 . . . . 2.24 110.842 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.24 -33.81 72.82 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.34 0.59 . . . . 2.26 110.896 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.8 t -74.04 -42.55 60.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 1.69 110.364 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 78.4 mt -64.32 -42.53 95.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.326 0.584 . . . . 1.2 109.886 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.34 -38.05 76.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.137 -0.938 . . . . 1.29 111.381 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.65 -38.08 80.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.412 0.625 . . . . 1.21 110.349 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.81 -35.55 67.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.289 -0.869 . . . . 1.13 111.17 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -63.37 -41.81 98.82 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 121.071 -0.252 . . . . 1.87 111.656 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.71 -33.57 66.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.929 0.395 . . . . 3.57 110.791 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.428 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 29.7 mmtm -77.82 -47.67 18.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.158 -0.474 . . . . 2.01 111.716 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -148.62 95.51 3.98 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-O 120.688 0.28 . . . . 1.68 110.67 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -41.07 -56.53 1.67 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 124.122 3.215 . . . . 0.84 113.827 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.02 -33.26 75.04 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 115.193 -0.912 . . . . 2.45 112.435 -178.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -72.25 -42.36 65.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.8 -0.815 . . . . 2.03 108.8 -176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.91 -33.99 88.7 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.051 -1.431 . . . . 0.41 111.449 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.1 72.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.763 0.316 . . . . 1.19 110.895 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 26.7 mtpp -67.03 -54.92 17.05 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.595 -0.275 . . . . 2.7 110.337 175.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.6 m -67.61 -22.61 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.166 0 C-N-CA 120.906 -0.318 . . . . 1.12 111.188 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.75 -58.26 9.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.064 -0.516 . . . . 1.7 109.838 172.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -71.95 -32.58 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.798 -0.637 . . . . 4.35 109.969 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.538 HD22 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -62.61 -41.6 99.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 2.09 109.452 179.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -74.3 -38.76 63.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.913 -0.773 . . . . 3.07 108.913 -176.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.33 95.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.821 -1.081 . . . . 1.26 111.014 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 28.9 mtp -55.88 -55.01 37.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.097 0.475 . . . . 1.21 110.8 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.3 t -58.58 -44.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-N 115.149 -0.932 . . . . 0.79 110.554 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -60.54 -37.51 81.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.671 -0.695 . . . . 2.03 111.512 177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.8 m -64.09 -37.78 88.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 1.66 110.859 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.667 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 95.8 mttt -72.44 -23.68 61.1 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.435 -0.348 . . . . 2.14 110.576 177.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.3 mt -89.15 -19.14 7.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.769 0.795 . . . . 1.1 110.159 175.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.03 -36.77 58.95 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.211 -0.904 . . . . 1.18 109.789 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.444 ' HB1' ' OE1' ' A' ' 135' ' ' GLN . . . -90.55 -8.01 51.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.722 -1.126 . . . . 1.11 109.448 -178.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.667 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.8 tp -86.9 121.9 30.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 106.377 -1.712 . . . . 1.34 106.377 172.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.791 ' N ' ' HD3' ' A' ' 79' ' ' PRO . . . -99.21 -12.36 42.53 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.528 1.371 . . . . 0.76 116.528 -172.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.791 ' HD3' ' N ' ' A' ' 78' ' ' GLY . 8.6 Cg_endo -98.97 -146.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.089 0 CA-C-N 121.501 2.651 . . . . 1.89 116.844 -170.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -80.01 -7.07 58.63 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 106.613 -1.625 . . . . 2.52 106.613 167.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 128' ' ' GLY . . . -68.88 -36.49 78.14 Favored 'General case' 0 CA--C 1.499 -0.982 0 CA-C-N 115.361 -0.836 . . . . 1.13 109.467 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 77' ' ' LEU . 1.0 OUTLIER -72.42 -36.75 68.69 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.635 -0.711 . . . . 2.52 109.098 177.031 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.36 -43.44 96.83 Favored Glycine 0 C--N 1.336 0.542 0 C-N-CA 120.091 -1.052 . . . . 0.46 111.623 174.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 88' ' ' SER . 8.8 t80 -66.06 -39.05 89.78 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.708 0.403 . . . . 2.04 111.063 176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.55 -43.03 79.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.483 0.658 . . . . 1.07 110.356 177.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 7.4 mm-40 -59.46 -30.88 68.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.008 -0.996 . . . . 1.96 111.108 177.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -87.37 -47.01 9.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.435 -0.348 . . . . 2.74 111.032 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.424 ' HB3' ' CE1' ' A' ' 84' ' ' PHE . 10.1 p -61.11 -47.08 87.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.198 -0.455 . . . . 0.65 111.472 -175.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.0 -40.11 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 1.79 110.279 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -62.8 -45.01 94.63 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.372 -0.377 . . . . 2.82 111.178 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -65.01 -46.56 91.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.579 -0.282 . . . . 1.2 110.932 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.73 88.46 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.299 0.571 . . . . 1.23 110.007 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt85 -59.38 -35.84 74.67 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.346 -0.843 . . . . 5.02 110.78 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.03 -35.34 90.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.018 -0.61 . . . . 0.72 112.474 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.1 mm -71.69 -48.22 53.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.095 0.474 . . . . 1.23 109.921 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -85.23 27.53 0.79 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.668 0.747 . . . . 3.16 110.258 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -117.06 -27.65 6.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 1.33 109.599 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.43 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 17.8 ptp180 -91.47 -1.03 57.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.116 -0.493 . . . . 3.64 109.997 176.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -83.65 -38.59 21.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.999 -0.741 . . . . 1.28 108.999 163.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.612 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 4.4 m-30 -67.86 -24.96 65.31 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.349 -0.841 . . . . 1.78 111.41 -173.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -77.65 -4.58 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.853 -0.612 . . . . 1.51 112.177 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.79 7.83 65.97 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.415 -0.897 . . . . 1.16 111.346 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -100.55 166.0 11.14 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.865 -0.791 . . . . 2.22 108.865 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.4 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 50.2 mt-10 -134.92 110.22 10.93 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 121.028 -0.269 . . . . 1.75 111.297 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.43 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 14.6 Cg_endo -61.55 151.55 79.24 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.416 2.078 . . . . 0.71 111.348 173.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.7 p -81.17 167.57 19.5 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.576 -0.527 . . . . 2.17 109.576 177.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 39.4 ttpt -64.24 -29.64 70.73 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.249 -0.649 . . . . 3.31 109.249 177.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -65.34 -36.28 83.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.241 -0.891 . . . . 2.24 110.896 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -60.69 -44.32 96.66 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.121 0.486 . . . . 1.73 109.985 173.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.32 -40.31 89.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.298 -0.864 . . . . 1.56 111.411 -178.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 94.5 mttt -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.091 0.472 . . . . 2.31 110.238 176.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.538 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -62.51 -43.98 97.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.765 -0.652 . . . . 1.19 111.541 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.2 p -61.77 -32.25 72.51 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.38 0.511 . . . . 1.84 112.38 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 6.9 m -87.63 -25.74 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-O 121.511 0.672 . . . . 0.66 110.126 -178.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.9 ptmm? -79.61 -24.62 41.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.509 -0.769 . . . . 2.26 110.937 -175.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 20.1 mm-40 -78.76 -38.95 37.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.341 -0.543 . . . . 2.27 110.438 175.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.5 m -66.36 -29.43 46.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.611 -0.435 . . . . 0.91 110.017 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.91 -40.83 78.89 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.086 -0.709 . . . . 1.75 109.086 172.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 5.4 tmmm? -54.02 -46.56 71.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.731 -0.668 . . . . 1.51 110.289 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.32 -46.82 81.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.384 -0.371 . . . . 1.68 111.342 171.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.659 ' HE1' ' CE2' ' A' ' 121' ' ' TYR . 48.3 t80 -72.54 -33.52 66.91 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 119.739 -0.784 . . . . 2.2 112.41 -167.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -63.77 -32.34 73.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 2.44 110.573 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.95 -4.34 59.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.232 0.827 . . . . 1.16 113.232 -171.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 37.4 mtm -75.53 155.68 35.85 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.093 -0.643 . . . . 1.15 110.712 -178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.6 m -60.79 146.65 45.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.52 -0.309 . . . . 1.57 110.208 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.19 -47.56 75.08 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.25 0.463 . . . . 2.21 112.25 -170.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.94 -33.14 68.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.063 0.459 . . . . 1.18 110.882 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -72.41 -38.33 58.23 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.477 -0.783 . . . . 0.35 111.651 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.32 -45.95 82.23 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.705 -0.48 . . . . 1.84 109.705 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.75 90.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.605 -0.725 . . . . 1.15 111.461 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.8 -29.92 70.9 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.018 0.437 . . . . 0.55 110.386 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 81' ' ' ALA . 88.6 t80 -58.8 -27.97 65.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.718 -0.673 . . . . 0.49 110.514 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.407 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -68.56 -23.59 75.31 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.243 -0.503 . . . . 0.27 113.145 -178.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.19 21.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.938 0.399 . . . . 2.95 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.444 ' OE1' ' HB1' ' A' ' 76' ' ' ALA . 32.9 mm-40 -82.55 -46.39 13.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.713 -0.676 . . . . 1.83 112.057 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 39.0 m-85 -122.08 73.33 36.67 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 121.144 0.497 . . . . 0.91 110.107 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.69 -25.79 33.66 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.994 2.463 . . . . 1.06 112.895 -171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.632 ' HE2' ' CE1' ' A' ' 138' ' ' PHE . 3.6 m-85 -68.72 -50.6 49.44 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.546 -0.297 . . . . 2.9 111.166 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.478 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -66.39 -44.35 83.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.676 -0.49 . . . . 1.67 109.676 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.407 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -55.34 -46.54 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.016 0.436 . . . . 1.04 110.612 177.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.519 ' HZ2' ' HB2' ' A' ' 141' ' ' LYS . 0.8 OUTLIER -47.59 -67.43 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.252 -0.886 . . . . 3.06 111.447 174.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.485 ' HB ' ' CG ' ' A' ' 147' ' ' LYS . 2.7 m -63.93 -23.07 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.014 -0.994 . . . . 0.5 112.798 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.478 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 22.2 m-30 -77.59 -44.54 28.06 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.316 -0.553 . . . . 0.92 110.746 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.07 -35.27 71.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.13 0.49 . . . . 2.58 110.13 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.1 m -82.6 167.57 18.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.37 -0.832 . . . . 1.81 110.307 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -78.79 55.25 4.2 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.895 -0.669 . . . . 1.41 111.502 176.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.485 ' CG ' ' HB ' ' A' ' 142' ' ' VAL . 15.7 tppt? -108.84 -76.3 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.228 -0.286 . . . . 2.46 110.228 -179.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.2 80.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 1.07 110.55 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.33 68.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 1.12 111.471 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -85.44 -38.07 19.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.187 -0.46 . . . . 3.27 111.111 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -58.34 -39.98 80.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.157 0.503 . . . . 0.68 109.783 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.64 -31.52 72.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.444 -0.798 . . . . 1.18 111.093 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.454 0 C-N-CA 120.938 -0.649 . . . . 1.62 111.673 -177.706 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.635 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 11.6 p90 . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.037 0.446 . . . . 2.09 111.045 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -113.83 165.68 12.33 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.887 -0.597 . . . . 3.54 109.68 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.661 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 69.0 t80 -55.33 -51.11 67.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 2.56 110.254 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -77.75 10.32 2.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.868 -0.605 . . . . 4.16 112.463 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.04 -19.57 15.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.127 0.489 . . . . 2.57 110.633 -177.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.445 ' HB ' ' HD3' ' A' ' 11' ' ' ARG . 50.9 mt -74.02 138.93 76.01 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.012 -0.736 . . . . 1.31 109.012 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.443 ' HG2' HD21 ' A' ' 110' ' ' LEU . 25.2 Cg_exo -37.69 110.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.492 2.795 . . . . 0.7 112.603 175.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.06 -17.39 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.681 -0.691 . . . . 1.23 111.923 -171.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -69.55 -32.3 71.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.923 0.868 . . . . 1.37 108.911 176.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.668 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 81.1 t80 -82.57 -38.11 24.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.044 -1.435 . . . . 1.08 110.816 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.445 ' HD3' ' HB ' ' A' ' 6' ' ' ILE . 50.6 mtm180 -67.18 -27.99 67.73 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.737 0.78 . . . . 2.1 109.622 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.93 -10.59 59.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.289 -1.323 . . . . 1.02 111.068 176.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.9 mt -97.95 -16.4 19.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.355 . . . . 1.49 110.311 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.417 ' HE1' ' HG2' ' A' ' 11' ' ' ARG . 53.3 mtm -82.24 135.13 47.77 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.316 -0.402 . . . . 1.65 111.209 -174.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.48 160.62 38.38 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.881 2.387 . . . . 1.12 112.489 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -43.65 -49.1 8.2 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 123.255 2.637 . . . . 1.3 112.913 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.18 -60.03 2.76 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.087 0.47 . . . . 2.26 111.412 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 -8.46 54.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 1.39 112.007 -173.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -96.84 -34.66 11.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.502 -0.317 . . . . 2.54 110.749 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -52.05 -47.65 64.99 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.361 0.413 . . . . 1.06 111.645 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.651 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 33.7 t80 -60.56 -60.24 4.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.172 -0.467 . . . . 0.73 111.571 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.454 HD23 ' CE1' ' A' ' 100' ' ' TYR . 34.6 mt -75.82 -4.65 41.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.274 0.943 . . . . 1.75 112.336 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -68.41 -36.19 78.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.498 -0.556 . . . . 2.56 109.498 163.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -78.02 -50.08 12.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.267 -0.879 . . . . 1.84 112.253 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.454 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.4 mm? -55.25 138.04 46.01 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.259 0.552 . . . . 1.7 110.786 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.3 m -121.58 -67.61 0.95 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 2.16 111.278 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -164.07 -52.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.74 0.274 . . . . 2.39 111.74 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -70.03 -30.8 69.69 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.829 -0.7 . . . . 1.47 111.552 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -72.53 -41.65 65.6 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.179 -0.511 . . . . 2.25 110.526 175.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.26 -20.68 63.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.13 0.49 . . . . 1.89 110.776 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 58.2 m -67.8 -30.07 69.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.631 -0.713 . . . . 1.37 110.936 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.81 -30.12 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-N 116.29 -0.414 . . . . 0.85 110.773 -178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.92 -45.85 71.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.351 0.12 . . . . 1.65 110.967 173.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 17.8 pttp -59.9 -27.08 66.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.591 -0.444 . . . . 2.89 110.959 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -78.18 -39.02 42.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.8 0.333 . . . . 1.96 110.439 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.3 m -69.83 -37.41 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.98 110.219 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 24.9 m-85 -67.49 -38.22 84.03 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.238 1.199 . . . . 1.08 114.238 173.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.496 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 10.0 mtmp? -85.25 16.87 3.33 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.627 -0.829 . . . . 2.71 110.291 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.93 11.57 17.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 1.57 109.541 174.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.69 -159.97 32.72 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.521 -0.763 . . . . 1.54 111.849 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.55 160.0 93.89 Favored 'Cis proline' 0 C--O 1.233 0.274 0 C-N-CA 123.675 -1.386 . . . . 1.99 112.839 1.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.536 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 60.0 m-85 -116.6 140.92 48.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.629 -0.714 . . . . 1.72 110.106 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.3 -12.97 60.16 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.634 -0.712 . . . . 4.11 110.289 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.547 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -158.06 165.58 34.68 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.116 -0.493 . . . . 1.53 110.286 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -65.89 -30.15 70.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.118 0.485 . . . . 1.72 110.588 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -54.08 -42.82 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.435 -0.802 . . . . 2.24 112.087 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.547 ' HG3' HD22 ' A' ' 44' ' ' ASN . 30.3 mt-10 -63.76 -33.14 74.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.418 -0.355 . . . . 2.26 111.131 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.5 t -73.21 -32.23 64.66 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.849 -0.426 . . . . 1.69 109.849 177.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.7 -40.84 90.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.406 0.622 . . . . 1.2 109.556 175.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.81 -46.18 90.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.035 -0.984 . . . . 1.29 110.879 175.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.77 -39.14 73.49 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.053 -0.522 . . . . 1.21 110.973 177.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.1 mt -71.21 -42.25 69.2 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 1.13 111.448 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -61.14 -34.66 75.35 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.874 0.368 . . . . 1.87 111.429 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -73.95 -38.29 64.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.056 -0.52 . . . . 3.57 111.657 -179.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -91.48 -36.89 13.49 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.228 0.455 . . . . 2.01 112.228 -175.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -145.18 88.27 6.83 Favored Pre-proline 0 C--N 1.32 -0.715 0 N-CA-C 109.336 -0.616 . . . . 1.68 109.336 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.483 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 63.1 Cg_exo -41.18 -54.41 2.59 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 124.102 3.201 . . . . 0.84 113.751 -170.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.601 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 6.1 mp0 -58.96 -36.0 74.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.945 -1.025 . . . . 2.45 112.326 -177.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.55 -36.6 79.01 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 120.011 -0.676 . . . . 2.03 109.315 -175.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.13 81.52 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.639 -1.164 . . . . 0.41 111.707 176.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 -38.79 63.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.75 0.31 . . . . 1.19 110.547 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.4 mmmt -63.2 -42.12 99.28 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.116 -0.493 . . . . 2.7 110.602 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.63 -30.07 16.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.392 -0.367 . . . . 1.12 110.718 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.46 -51.86 63.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.549 -0.296 . . . . 1.7 110.628 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.483 ' O ' ' HG3' ' A' ' 69' ' ' MET . 20.9 pttp -60.11 -35.49 75.34 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.774 0.797 . . . . 4.35 109.573 -177.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.492 HD11 ' C ' ' A' ' 66' ' ' LEU . 1.5 tm? -65.04 -48.5 73.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.387 -1.279 . . . . 2.09 110.303 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.574 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 84.2 t60 -77.98 -32.12 51.09 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.52 -0.548 . . . . 3.07 109.52 -170.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.37 93.6 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.379 -0.828 . . . . 1.26 111.528 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 60.7 mtm -56.32 -52.15 65.59 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.649 0.738 . . . . 1.21 109.367 174.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t -51.66 -49.47 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 114.107 -1.406 . . . . 0.79 110.917 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.1 mmmt -63.2 -40.63 98.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.749 . . . . 2.03 111.928 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.9 t -60.56 -40.05 90.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.022 0.439 . . . . 1.66 110.666 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.534 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 95.2 mttt -74.0 -41.71 61.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.836 -0.62 . . . . 2.14 110.788 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -69.93 -26.24 29.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.196 0.522 . . . . 1.1 110.807 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.6 81.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.579 0.704 . . . . 1.18 109.924 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.07 -2.29 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.743 -1.117 . . . . 1.11 110.743 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -95.05 133.28 39.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.823 -0.626 . . . . 1.34 109.731 -176.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.41 151.2 50.54 Favored Glycine 0 C--O 1.226 -0.394 0 C-N-CA 120.8 -0.714 . . . . 0.76 112.0 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -39.17 -40.4 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.391 3.394 . . . . 1.89 114.495 -176.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -70.02 -46.24 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.263 -0.175 . . . . 2.52 111.236 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.29 -33.17 37.91 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.606 0.717 . . . . 1.13 109.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -58.03 -44.4 87.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.676 -1.147 . . . . 2.52 111.304 177.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.23 -38.83 96.29 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 0.46 111.927 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 15.4 t80 -68.47 -44.05 75.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.526 0.203 . . . . 2.04 110.998 176.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.22 85.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.034 0.445 . . . . 1.07 111.024 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -62.46 -39.71 94.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.83 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -71.06 -51.28 26.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 2.74 111.529 -177.263 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.3 p -59.15 -39.91 83.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.952 0.406 . . . . 0.65 110.997 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.7 mt -70.34 -41.03 78.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 116.091 -0.504 . . . . 1.79 111.603 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 14.8 pt-20 -69.68 -28.01 65.49 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.454 -0.498 . . . . 2.82 110.668 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 98.2 mt -69.77 -48.96 61.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.014 0.435 . . . . 1.2 110.044 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.49 -33.93 76.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.92 -0.582 . . . . 1.23 110.734 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -56.96 -39.78 75.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.955 -0.566 . . . . 5.02 110.38 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 98' ' ' ARG . . . -66.98 -30.72 76.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.927 -0.654 . . . . 0.72 112.015 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -63.53 -53.8 40.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.075 0.464 . . . . 1.23 110.542 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -74.48 -15.67 60.88 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.361 -0.382 . . . . 3.16 110.863 177.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.03 71.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 119.936 -0.706 . . . . 1.33 109.989 170.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.483 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 47.1 mtt180 -88.77 -9.43 51.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.184 -0.462 . . . . 3.64 110.186 176.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.471 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 30.6 m-85 -83.25 -43.94 15.51 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.392 -0.596 . . . . 1.28 109.392 167.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.67 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 25.8 m-85 -61.08 -36.3 79.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.192 -0.458 . . . . 1.78 111.778 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 1.8 p -74.49 -11.44 60.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 1.51 112.737 -176.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.14 58.76 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.839 -0.696 . . . . 1.16 113.225 -176.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -88.71 -42.89 11.68 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.907 0.354 . . . . 2.22 111.236 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 65.41 88.88 0.11 Allowed Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 123.728 0.642 . . . . 1.75 112.321 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.94 144.43 5.96 Favored 'Trans proline' 0 C--O 1.237 0.457 0 C-N-CA 123.62 2.88 . . . . 0.71 113.019 172.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.7 t -79.61 166.0 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.047 -0.723 . . . . 2.17 109.047 174.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.521 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 22.0 ptmt -58.03 -34.44 70.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.283 0.492 . . . . 3.31 110.496 -176.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.99 -25.55 66.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.746 -0.661 . . . . 2.24 111.493 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -70.16 -40.59 74.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.347 0.594 . . . . 1.73 109.982 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.458 HD22 ' CG ' ' A' ' 10' ' ' TYR . 9.9 mp -72.41 -39.68 67.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 1.56 110.716 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.0 mtpm? -58.32 -47.02 85.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.229 0.538 . . . . 2.31 110.021 176.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -64.53 -39.25 93.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.532 -0.758 . . . . 1.19 112.301 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.9 p -71.88 -31.9 66.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.396 0.517 . . . . 1.84 112.396 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 5.9 m -78.41 -24.43 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.458 0.647 . . . . 0.66 109.307 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 63.5 mttm -53.26 -48.78 67.99 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.276 -0.874 . . . . 2.26 111.385 174.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.512 ' O ' HD11 ' A' ' 120' ' ' LEU . 6.4 mm-40 -70.27 -33.42 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.391 -0.368 . . . . 2.27 110.922 -171.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.3 m -67.95 -28.03 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 C-N-CA 120.231 -0.588 . . . . 0.91 109.95 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 149' ' ' ALA . 44.3 mt -82.35 -30.31 30.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.81 0.338 . . . . 1.75 110.283 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -61.49 -35.42 77.61 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.607 0.718 . . . . 1.51 109.264 177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' A' ' 124' ' ' MET . 10.8 mp -81.87 -45.7 15.13 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 114.755 -1.111 . . . . 1.68 111.369 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.625 ' HD2' ' CD1' ' A' ' 121' ' ' TYR . 47.4 t80 -74.63 -36.32 62.91 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 119.301 -0.96 . . . . 2.2 111.611 -169.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -66.66 -29.49 69.51 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.221 -0.659 . . . . 2.44 109.221 176.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -102.22 72.1 1.28 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.189 -0.914 . . . . 1.16 110.809 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.6 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 32.0 mtm -150.02 157.47 43.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.691 -0.686 . . . . 1.15 110.669 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.4 m -62.57 138.35 58.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.228 0.537 . . . . 1.57 110.445 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -58.49 -37.88 76.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.128 -0.942 . . . . 2.21 112.533 -172.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.92 -34.83 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 1.18 110.834 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.69 -38.69 56.86 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.985 -0.626 . . . . 0.35 111.64 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.79 -45.22 90.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.042 0.448 . . . . 1.84 110.608 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.0 71.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.77 -0.65 . . . . 1.15 111.782 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -74.23 -30.72 62.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.55 109.823 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -60.32 -31.08 69.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.912 -0.586 . . . . 0.49 109.928 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.75 -12.03 73.95 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 121.092 -0.575 . . . . 0.27 112.849 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -86.51 -33.29 20.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.58 0.705 . . . . 2.95 109.781 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.6 mm-40 -92.25 -38.8 11.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.001 -1.0 . . . . 1.83 110.934 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.656 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 71.4 m-85 -131.26 75.14 78.19 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-O 121.215 0.531 . . . . 0.91 110.166 177.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -66.86 -29.38 41.77 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.433 2.756 . . . . 1.06 113.043 -175.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.658 ' HE2' ' CE1' ' A' ' 138' ' ' PHE . 26.0 t80 -74.45 -37.04 63.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.949 0.404 . . . . 2.9 109.933 -177.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -74.9 -46.64 34.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 1.67 110.302 177.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.492 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.95 -39.16 74.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 1.04 109.907 177.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 55.2 tttp -44.4 -68.31 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.131 -0.94 . . . . 3.06 111.701 172.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.2 m -71.9 -16.24 18.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 114.997 -1.001 . . . . 0.5 112.753 -173.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.466 ' HB3' ' CD2' ' A' ' 121' ' ' TYR . 22.3 m-30 -84.95 -36.41 21.41 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.433 -0.507 . . . . 0.92 110.941 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 48.0 mt-10 -66.42 -52.35 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.081 0.467 . . . . 2.58 109.881 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -75.16 159.45 31.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.682 -0.69 . . . . 1.81 109.929 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.07 52.41 3.32 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.738 -0.744 . . . . 1.41 111.828 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -100.06 -64.25 1.06 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.789 0.328 . . . . 2.46 110.155 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.45 -33.76 69.64 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.301 0.572 . . . . 1.07 109.544 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.436 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -55.79 -37.91 69.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.098 -0.956 . . . . 1.12 111.55 177.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -85.81 -20.21 29.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.541 -0.3 . . . . 3.27 111.413 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -74.34 -34.07 63.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.532 0.682 . . . . 0.68 109.316 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -79.92 -42.53 23.89 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.189 -0.914 . . . . 1.18 111.565 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 110.616 -0.994 . . . . 1.62 110.616 -170.841 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 0.75 ' CD1' ' HG2' ' A' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 121.655 0.74 . . . . 2.09 111.325 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 tmtp? -100.94 50.5 0.87 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.692 -1.14 . . . . 3.54 109.435 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.639 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 0.9 OUTLIER 62.06 23.44 13.82 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 107.289 -1.374 . . . . 2.56 107.289 -166.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.75 ' HG2' ' CD1' ' A' ' 1' ' ' PHE . 16.0 mm-40 46.64 17.79 0.06 Allowed 'General case' 0 C--N 1.344 0.335 0 N-CA-C 116.441 2.015 . . . . 4.16 116.441 171.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.9 t70 48.97 29.98 2.59 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.47 0.652 . . . . 2.57 109.9 -172.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 83.2 mt -52.71 132.75 46.78 Favored Pre-proline 0 CA--C 1.519 -0.229 0 CA-C-N 115.673 -0.694 . . . . 1.31 110.376 -174.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -35.22 109.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 123.982 3.121 . . . . 0.7 112.899 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.29 -17.02 51.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.59 -0.732 . . . . 1.23 111.597 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -67.7 -35.46 78.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.703 . . . . 1.37 109.275 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.622 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 41.4 t80 -89.1 -24.45 22.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.383 -1.28 . . . . 1.08 111.098 -176.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -71.21 -22.93 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.041 -0.725 . . . . 2.1 109.041 177.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -24.52 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.774 -1.103 . . . . 1.02 110.541 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 10' ' ' TYR . 9.9 mp -80.37 -43.89 20.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.481 -0.781 . . . . 1.49 110.669 178.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 69.8 mtm -68.36 131.54 91.77 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 1.65 110.844 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.417 ' HD3' HD23 ' A' ' 139' ' ' LEU . 26.9 Cg_endo -63.24 152.44 79.78 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 1.12 111.989 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -53.08 -27.46 36.65 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.621 2.88 . . . . 1.3 112.847 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.539 ' O ' HD22 ' A' ' 66' ' ' LEU . 31.0 mt-10 -64.59 -50.17 68.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.898 -0.592 . . . . 2.26 110.641 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.65 70.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.998 0.428 . . . . 1.39 110.978 -178.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -75.64 -32.77 60.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.606 -0.725 . . . . 2.54 110.505 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -52.5 -45.9 66.41 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.866 -0.606 . . . . 1.06 111.318 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 44.1 t80 -57.72 -63.21 1.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.952 -0.567 . . . . 0.73 111.657 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.477 HD23 ' CE1' ' A' ' 100' ' ' TYR . 48.9 mt -73.45 -9.91 59.18 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 119.539 1.063 . . . . 1.75 112.484 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.94 -36.89 80.9 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.013 0.435 . . . . 2.56 110.059 164.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -80.47 -48.76 12.34 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.958 -0.564 . . . . 1.84 111.142 -178.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.561 ' HB3' ' CE ' ' A' ' 30' ' ' LYS . 4.4 mm? -57.61 131.52 50.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.439 0.637 . . . . 1.7 111.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.6 m -130.79 -90.39 0.45 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.341 -0.845 . . . . 2.16 111.351 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -125.08 -62.13 1.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.086 0.402 . . . . 2.39 112.086 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -61.75 -45.63 95.86 Favored Glycine 0 N--CA 1.453 -0.168 0 C-N-CA 121.101 -0.571 . . . . 1.47 113.109 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -72.49 -32.61 66.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.22 0.533 . . . . 2.25 110.276 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.561 ' CE ' ' HB3' ' A' ' 25' ' ' LEU . 1.1 tppp? -55.54 -34.84 65.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 1.89 111.049 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.6 m -51.99 -41.87 62.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.128 -0.942 . . . . 1.37 112.292 176.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.0 p -86.68 -24.2 6.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.464 -0.335 . . . . 0.85 111.49 -171.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.476 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.3 mm? -49.92 -53.08 28.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.789 0.328 . . . . 1.65 111.873 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -64.06 -21.08 66.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 2.89 111.373 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -76.66 -22.08 54.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.19 -0.459 . . . . 1.96 110.829 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.6 t -91.84 -52.3 10.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.578 0.704 . . . . 0.98 110.189 177.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.65 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 64.8 m-85 -58.24 -39.58 79.5 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.941 1.089 . . . . 1.08 113.941 177.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -85.07 16.89 3.2 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.847 -0.741 . . . . 2.71 110.862 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.78 21.0 11.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.557 -0.747 . . . . 1.57 109.945 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.77 -153.91 9.95 Favored Glycine 0 N--CA 1.452 -0.242 0 N-CA-C 111.32 -0.712 . . . . 1.54 111.32 174.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -83.52 150.64 65.58 Favored 'Cis proline' 0 C--N 1.344 0.318 0 CA-C-N 119.331 1.565 . . . . 1.99 112.761 -2.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -86.5 134.14 33.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.915 -0.584 . . . . 1.72 110.011 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -89.27 -17.36 29.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.315 -0.857 . . . . 4.11 109.219 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.475 HD22 ' HG3' ' A' ' 47' ' ' GLU . 4.8 p30 -145.99 163.37 35.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.28 -0.873 . . . . 1.53 110.011 -177.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.0 m -65.55 -41.81 92.58 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 1.72 111.436 -177.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -55.7 -34.92 65.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 2.24 112.534 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.475 ' HG3' HD22 ' A' ' 44' ' ' ASN . 31.6 mt-10 -56.76 -39.49 74.13 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.034 0.383 . . . . 2.26 112.034 -177.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.2 t -69.04 -43.87 73.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.958 0.409 . . . . 1.69 109.931 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.1 mt -64.52 -44.11 96.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.692 -0.686 . . . . 1.2 110.375 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.29 79.5 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.141 -0.936 . . . . 1.29 112.069 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.99 -34.76 79.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.937 0.399 . . . . 1.21 110.81 -177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.403 HD22 HD11 ' A' ' 33' ' ' LEU . 16.9 mt -69.49 -32.2 70.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.912 -0.586 . . . . 1.13 111.318 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -67.44 -40.73 85.44 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.836 -0.346 . . . . 1.87 111.188 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -66.4 -28.51 68.68 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.223 0.535 . . . . 3.57 110.869 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.528 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 40.3 mmtt -85.69 -44.12 12.83 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.892 -0.595 . . . . 2.01 112.043 176.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -151.5 103.93 2.91 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 120.712 -0.395 . . . . 1.68 111.361 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -41.31 -62.69 0.37 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 123.87 3.047 . . . . 0.84 113.485 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.36 -29.24 69.94 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.801 -1.09 . . . . 2.45 111.387 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tt -73.22 -42.18 62.91 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.407 -0.96 . . . . 2.03 108.407 -176.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.45 -25.6 71.44 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 114.353 -1.294 . . . . 0.41 111.467 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.78 -32.03 63.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.938 0.399 . . . . 1.19 110.444 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -67.7 -37.99 83.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.282 -0.417 . . . . 2.7 111.178 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -80.13 -29.56 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.176 0.512 . . . . 1.12 110.061 175.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.15 -48.91 79.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.86 -0.609 . . . . 1.7 110.782 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.17 -30.57 71.16 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 121.397 0.617 . . . . 4.35 109.432 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.539 HD22 ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -73.33 -3.85 29.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.075 -0.966 . . . . 2.09 111.872 -178.17 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -122.13 -29.68 4.17 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.126 -0.63 . . . . 3.07 110.487 171.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.37 -47.34 64.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.659 0.244 . . . . 1.26 111.659 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 35.7 mtm -62.63 -39.33 93.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.747 0.784 . . . . 1.21 109.484 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.0 t -69.55 -35.49 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 114.709 -1.132 . . . . 0.79 110.583 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.12 -39.65 90.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.947 -0.57 . . . . 2.03 110.568 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -55.44 -36.5 66.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.413 0.625 . . . . 1.66 110.371 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 43.7 mttp -77.69 -54.25 6.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.996 -1.002 . . . . 2.14 110.118 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.4 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.6 mt -61.76 -23.2 30.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 1.1 111.361 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.82 65.5 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.66 -0.7 . . . . 1.18 109.856 177.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.85 -2.98 52.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.813 -1.085 . . . . 1.11 110.016 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 132' ' ' PHE . 6.8 tp -91.23 135.46 33.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.001 -0.999 . . . . 1.34 109.58 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.68 159.75 48.24 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.803 -0.713 . . . . 0.76 111.829 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -47.73 -38.22 29.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.304 2.669 . . . . 1.89 113.227 -177.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -63.53 -47.73 80.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.343 -0.39 . . . . 2.52 111.228 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 128' ' ' GLY . . . -87.05 -29.79 21.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.104 -0.498 . . . . 1.13 111.419 -174.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.0 ttpt -57.87 -41.74 83.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.09 -0.505 . . . . 2.52 111.319 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.09 -41.26 96.45 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.564 -0.826 . . . . 0.46 112.083 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -71.57 -41.56 68.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.801 -0.2 . . . . 2.04 111.057 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.445 ' O ' HD11 ' A' ' 89' ' ' ILE . . . -57.81 -49.57 76.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.871 0.367 . . . . 1.07 111.666 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.93 -29.3 69.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.353 -0.385 . . . . 1.96 111.522 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.686 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.4 OUTLIER -88.42 -38.29 15.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 111.743 0.275 . . . . 2.74 111.743 -176.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.5 p -60.3 -39.8 88.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.101 0.477 . . . . 0.65 109.769 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.445 HD11 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -63.82 -41.32 92.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.681 -0.69 . . . . 1.79 110.879 175.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.686 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 8.0 pt-20 -67.16 -32.72 74.01 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.837 -0.345 . . . . 2.82 110.736 -177.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.3 mt -73.23 -52.31 22.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.82 0.343 . . . . 1.2 110.546 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.8 -43.34 98.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.076 -0.511 . . . . 1.23 111.206 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' A' ' 97' ' ' ALA . 12.3 ptt180 -66.3 -23.38 66.37 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.132 -0.485 . . . . 5.02 110.454 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.0 -41.33 55.0 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.005 -0.617 . . . . 0.72 112.137 -179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.0 mm -65.61 -44.39 93.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.818 0.818 . . . . 1.23 109.125 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 ttpp -88.45 29.03 1.02 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.673 -1.148 . . . . 3.16 109.887 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 93' ' ' ARG . . . -121.75 -34.48 3.39 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.113 -0.949 . . . . 1.33 110.567 168.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.619 ' O ' ' HB3' ' A' ' 103' ' ' ASN . 17.1 ptm180 -80.88 0.07 36.81 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 120.194 -0.602 . . . . 3.64 109.498 176.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.474 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 5.6 m-85 -81.27 -28.78 34.56 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.024 -0.361 . . . . 1.28 110.024 165.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.66 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 30.9 m-85 -72.44 -34.18 67.59 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.963 0.411 . . . . 1.78 111.272 -178.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.4 p -73.53 -12.08 60.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.659 -0.701 . . . . 1.51 112.554 -173.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.78 55.08 Favored Glycine 0 N--CA 1.453 -0.232 0 N-CA-C 111.103 -0.799 . . . . 1.16 111.103 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.619 ' HB3' ' O ' ' A' ' 98' ' ' ARG . 40.6 t-20 -87.89 162.3 17.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.038 -1.097 . . . . 2.22 108.038 176.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -139.46 97.92 8.26 Favored Pre-proline 0 C--N 1.32 -0.705 0 O-C-N 122.114 -0.366 . . . . 1.75 110.84 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.05 139.89 91.17 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.443 2.095 . . . . 0.71 111.634 178.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.3 t -78.55 165.98 23.1 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.49 -0.559 . . . . 2.17 109.49 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.1 pttp -58.0 -33.78 69.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.279 0.561 . . . . 3.31 110.373 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.97 -25.92 65.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.438 -0.801 . . . . 2.24 111.015 -179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -67.81 -45.24 75.3 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.364 -0.606 . . . . 1.73 109.364 176.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.1 mp -63.77 -44.99 91.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.372 -0.831 . . . . 1.56 110.4 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 30.1 mtpp -56.29 -42.41 77.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 2.31 110.432 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.26 77.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.572 -0.74 . . . . 1.19 111.596 177.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.1 p -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.169 0.433 . . . . 1.84 112.169 -177.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -77.73 -23.67 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.828 0.823 . . . . 0.66 109.598 -177.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -67.19 -39.46 86.39 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.093 -0.958 . . . . 2.26 111.26 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 14.1 mm-40 -71.45 -34.32 70.13 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.463 -0.495 . . . . 2.27 110.772 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.78 -33.55 64.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.377 -0.529 . . . . 0.91 109.932 174.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.485 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 62.8 mt -72.18 -33.94 68.06 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.76 -0.459 . . . . 1.75 109.76 174.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.1 ttpt -56.93 -44.24 82.3 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.891 -0.781 . . . . 1.51 108.891 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.91 -48.52 53.18 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.872 -1.058 . . . . 1.68 111.467 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.66 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 51.0 t80 -71.24 -30.87 66.86 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 119.498 -0.881 . . . . 2.2 111.526 -167.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -66.84 -35.05 79.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.032 0.444 . . . . 2.44 110.793 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -88.58 -10.21 49.54 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.88 0.696 . . . . 1.16 112.88 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.5 mtm -71.15 156.36 39.67 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.837 -0.345 . . . . 1.15 111.692 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 129' ' ' LYS . 46.8 t -53.2 141.15 24.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.001 -0.545 . . . . 1.57 110.155 173.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.37 -48.9 77.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.816 0.341 . . . . 2.21 110.924 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.66 75.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.541 . . . . 1.18 110.815 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . 0.43 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -73.13 -44.59 35.0 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.751 -0.659 . . . . 0.35 112.607 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 121' ' ' TYR . 14.1 ptmm? -71.15 -29.08 64.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.989 0.423 . . . . 1.84 110.918 -177.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.37 65.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 1.15 110.985 174.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.408 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 26.4 t70 -67.33 -27.91 67.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.296 0.57 . . . . 0.55 109.702 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.435 ' HA ' HD12 ' A' ' 77' ' ' LEU . 88.4 t80 -61.49 -25.21 67.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.224 -0.898 . . . . 0.49 110.529 174.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.482 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -75.07 -12.48 83.39 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.891 -0.671 . . . . 0.27 113.344 -177.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 66.6 mttt -90.52 -48.23 7.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.434 0.635 . . . . 2.95 110.01 -178.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.412 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.8 mp0 -79.8 -31.97 40.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.115 -0.948 . . . . 1.83 110.732 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.657 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 5.9 m-85 -124.75 74.64 64.36 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.786 0.327 . . . . 0.91 110.755 175.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.14 -33.97 23.49 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.954 2.436 . . . . 1.06 112.948 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.401 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 37.3 t80 -73.93 -42.38 60.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.724 0.297 . . . . 2.9 110.718 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.417 HD23 ' HD3' ' A' ' 15' ' ' PRO . 58.2 mt -70.92 -44.27 66.53 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.942 -0.303 . . . . 1.67 110.624 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.482 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -59.36 -39.42 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 1.04 110.148 178.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.2 tttm -46.12 -65.75 0.5 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.315 -0.857 . . . . 3.06 111.456 172.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.19 -18.59 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.391 -0.822 . . . . 0.5 112.883 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.416 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 18.6 m-85 -81.75 -41.99 20.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.103 -0.639 . . . . 0.92 110.933 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -70.32 -39.17 74.92 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.115 0.483 . . . . 2.58 110.6 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.0 t -83.95 161.66 20.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.615 -0.721 . . . . 1.81 109.306 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.67 57.74 3.82 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.626 -0.797 . . . . 1.41 112.678 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.411 ' HZ3' ' HB2' ' A' ' 147' ' ' LYS . 3.1 ttmp? -106.55 -69.18 0.84 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.798 -0.445 . . . . 2.46 109.798 175.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.04 -40.69 87.23 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.057 0.456 . . . . 1.07 109.783 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.485 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.99 -43.52 81.78 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.521 -0.763 . . . . 1.12 110.652 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.02 -38.56 86.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.052 0.453 . . . . 3.27 110.413 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 26.3 t80 -67.52 -34.37 76.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.615 -0.72 . . . . 0.68 111.305 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -89.37 -37.26 14.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.933 0.716 . . . . 1.18 112.933 -174.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.472 0 N-CA-C 110.814 -0.914 . . . . 1.62 110.814 -169.839 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.629 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 4.7 p90 . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.104 0.478 . . . . 2.09 110.483 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.518 ' HB3' ' OD1' ' A' ' 5' ' ' ASP . 75.3 tttt -135.62 158.1 45.23 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.043 -0.725 . . . . 3.54 109.043 170.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.656 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 44.3 t80 -49.27 -51.52 33.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.167 0.508 . . . . 2.56 110.288 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.32 -20.34 66.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.245 -0.889 . . . . 4.16 112.405 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.518 ' OD1' ' HB3' ' A' ' 2' ' ' LYS . 2.6 m-20 -88.58 -18.8 27.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.865 0.364 . . . . 2.57 110.971 -175.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.2 mt -72.86 131.25 84.19 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.795 -0.817 . . . . 1.31 108.795 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.573 ' HD2' ' HH ' ' A' ' 99' ' ' TYR . 55.0 Cg_exo -41.33 113.28 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.217 2.611 . . . . 0.7 112.163 177.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -19.65 65.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.798 . . . . 1.23 112.218 -171.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.44 -33.47 76.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.773 0.797 . . . . 1.37 109.372 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.665 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 76.1 t80 -83.81 -37.29 22.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.201 -1.363 . . . . 1.08 111.502 -175.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -66.13 -31.87 72.99 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.798 -0.815 . . . . 2.1 108.798 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -15.29 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.042 -1.435 . . . . 1.02 111.908 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.4 mt -92.28 -33.95 14.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.721 0.296 . . . . 1.49 110.688 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.497 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 70.3 mtm -70.19 142.56 90.09 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 1.65 111.191 -176.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.65 149.13 60.75 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.65 2.234 . . . . 1.12 111.906 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -44.37 -49.39 8.98 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.866 3.044 . . . . 1.3 113.599 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.49 ' O ' HD22 ' A' ' 66' ' ' LEU . 46.5 mt-10 -59.05 -43.25 91.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.688 0.28 . . . . 2.26 111.703 -176.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.83 -7.12 49.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 1.39 111.227 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 14' ' ' MET . 62.2 mtp180 -101.01 -32.54 10.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.85 -0.614 . . . . 2.54 110.189 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.81 -46.31 50.91 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.854 -0.612 . . . . 1.06 111.392 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.622 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 58.0 t80 -56.24 -56.59 19.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.965 -0.561 . . . . 0.73 111.526 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.41 HD13 ' CE1' ' A' ' 100' ' ' TYR . 2.6 mm? -78.66 -7.52 57.75 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.609 1.095 . . . . 1.75 111.984 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -70.97 -32.86 69.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.93 0.395 . . . . 2.56 110.152 164.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -82.67 -49.6 9.62 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.737 -0.665 . . . . 1.84 112.244 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.66 HD21 ' O ' ' A' ' 21' ' ' PHE . 2.9 mm? -52.26 134.15 33.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.382 0.61 . . . . 1.7 111.005 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.1 t -130.01 -69.55 0.67 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.444 -0.798 . . . . 2.16 111.289 -174.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -141.24 -78.07 0.28 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.193 0.442 . . . . 2.39 112.193 -172.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.405 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -62.75 -30.84 78.19 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.157 -0.474 . . . . 1.47 112.594 -174.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.4 ' HB2' HD11 ' A' ' 25' ' ' LEU . 0.7 OUTLIER -66.9 -51.69 52.3 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.636 -0.282 . . . . 2.25 110.898 176.694 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 87.7 mttt -56.87 -27.31 60.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.116 0.484 . . . . 1.89 110.886 176.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 45.3 m -65.2 -26.92 68.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.774 . . . . 1.37 110.717 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.9 p -98.27 -23.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 120.64 -0.424 . . . . 0.85 110.808 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.4 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.0 mm? -54.07 -50.36 66.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.74 -0.209 . . . . 1.65 111.14 171.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 0.0 OUTLIER -64.97 -25.48 67.89 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.726 0.298 . . . . 2.89 111.712 -177.204 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.41 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 9.0 mm-40 -68.97 -39.12 79.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.348 -0.387 . . . . 1.96 110.281 175.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.75 -50.66 42.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.936 -0.574 . . . . 0.98 110.379 178.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.406 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 20.4 m-85 -54.6 -46.45 73.8 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 114.066 1.135 . . . . 1.08 114.066 177.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -84.6 7.86 18.74 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.662 -0.815 . . . . 2.71 111.201 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.27 12.24 32.03 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.087 -0.709 . . . . 1.57 109.087 171.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -97.27 -152.26 28.45 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.209 -0.905 . . . . 1.54 111.242 175.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.74 153.65 95.54 Favored 'Cis proline' 0 C--N 1.344 0.3 0 CA-C-N 119.088 1.444 . . . . 1.99 112.655 -0.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 98.6 m-85 -103.83 140.65 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.86 -0.609 . . . . 1.72 110.095 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -76.58 -15.73 59.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.464 -0.789 . . . . 4.11 110.239 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.94 148.08 25.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.713 -0.676 . . . . 1.53 110.327 -177.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.8 t -68.91 -18.66 64.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.074 -0.512 . . . . 1.72 111.525 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -57.12 -46.35 82.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.902 0.382 . . . . 2.24 110.739 176.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.2 OUTLIER -63.6 -29.74 70.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.038 -0.528 . . . . 2.26 111.367 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.0 t -72.43 -42.1 65.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.722 -0.473 . . . . 1.69 109.722 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.84 -46.36 88.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.776 -0.647 . . . . 1.2 110.205 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.42 -49.51 67.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.182 -0.917 . . . . 1.29 111.673 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.79 82.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.183 0.516 . . . . 1.21 110.788 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.1 mt -69.73 -37.06 76.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 1.13 111.086 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -62.91 -38.74 92.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.915 0.388 . . . . 1.87 111.67 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.154 0.502 . . . . 3.57 110.988 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -77.41 -46.49 22.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.827 -0.624 . . . . 2.01 111.852 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.431 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 68.6 m -146.11 97.01 4.52 Favored Pre-proline 0 C--N 1.315 -0.918 0 N-CA-C 110.108 -0.33 . . . . 1.68 110.108 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 5.7 Cg_endo -47.5 -62.94 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.855 3.036 . . . . 0.84 113.553 -167.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 11.2 pt-20 -67.14 -25.55 66.24 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.162 -0.926 . . . . 2.45 111.749 -177.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -74.29 -41.67 60.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.529 -0.915 . . . . 2.03 108.529 -177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.9 -23.71 77.75 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 114.596 -1.183 . . . . 0.41 111.639 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.28 -32.51 71.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.804 0.335 . . . . 1.19 110.454 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 67.9 mttm -64.93 -49.85 68.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 2.7 110.766 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.27 -29.9 48.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.925 0.393 . . . . 1.12 110.348 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.79 -61.66 2.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.539 . . . . 1.7 111.002 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.9 mptt -59.78 -37.07 78.06 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.11 0.481 . . . . 4.35 110.596 -174.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.49 HD22 ' O ' ' A' ' 17' ' ' GLU . 3.3 tm? -64.61 -43.7 92.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.123 -0.944 . . . . 2.09 110.278 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.438 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 t60 -78.82 -32.97 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.321 -0.622 . . . . 3.07 109.321 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.51 98.59 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.12 -0.946 . . . . 1.26 111.832 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' A' ' 66' ' ' LEU . 61.5 mtm -59.83 -51.08 71.27 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.411 0.624 . . . . 1.21 110.06 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.02 -43.58 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 114.786 -1.097 . . . . 0.79 110.687 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.4 mmmt -61.12 -38.84 87.8 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.92 -0.582 . . . . 2.03 111.386 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -63.17 -37.22 86.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.26 0.553 . . . . 1.66 110.801 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.35 -43.37 64.15 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 2.14 110.416 177.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.99 -22.5 27.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.477 0.656 . . . . 1.1 110.245 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.04 -36.25 72.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.931 0.872 . . . . 1.18 109.851 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.01 -2.08 55.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.301 -1.318 . . . . 1.11 110.27 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.41 HD13 ' OD2' ' A' ' 131' ' ' ASP . 8.5 tp -92.01 137.03 32.7 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 1.34 109.605 -176.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.39 156.66 52.21 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.755 -0.736 . . . . 0.76 111.964 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -44.29 -41.43 13.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.86 3.04 . . . . 1.89 114.235 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -67.43 -50.22 60.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.71 0.291 . . . . 2.52 110.76 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.24 -31.35 58.31 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.258 -0.577 . . . . 1.13 110.297 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.35 -45.58 87.92 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.475 -0.784 . . . . 2.52 111.187 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.12 -40.85 96.17 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.899 -0.667 . . . . 0.46 112.177 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.5 t80 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.99 -0.105 . . . . 2.04 111.278 177.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.432 ' O ' HD11 ' A' ' 89' ' ' ILE . . . -55.51 -44.92 77.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.95 0.405 . . . . 1.07 111.657 -175.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 40.6 mt-10 -71.19 -22.26 62.04 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.544 -0.462 . . . . 1.96 110.846 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -79.5 -40.3 30.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.619 -0.264 . . . . 2.74 111.249 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.3 p -61.78 -27.04 68.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.061 0.457 . . . . 0.65 110.3 176.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.432 HD11 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -74.34 -50.51 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.918 -0.583 . . . . 1.79 110.132 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 42.1 mt-10 -58.23 -53.64 55.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.191 0.441 . . . . 2.82 112.191 -177.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.72 -45.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.276 -0.42 . . . . 1.2 111.218 -174.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.63 -40.88 84.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 1.23 110.872 179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -63.5 -31.05 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.87 -0.605 . . . . 5.02 110.673 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.14 -36.15 89.82 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.782 -0.723 . . . . 0.72 111.896 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 43.9 mm -67.66 -50.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.058 0.456 . . . . 1.23 110.42 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 39.4 pttt -82.12 0.19 41.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.159 -0.473 . . . . 3.16 111.646 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.52 -27.99 60.78 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.127 -0.694 . . . . 1.33 109.127 164.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.514 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 66.6 mtp180 -86.69 -7.61 58.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.679 -0.691 . . . . 3.64 109.579 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.573 ' HH ' ' HD2' ' A' ' 7' ' ' PRO . 9.8 m-85 -81.89 -41.36 21.05 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.349 -0.611 . . . . 1.28 109.349 167.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.669 ' HD2' ' CD1' ' A' ' 100' ' ' TYR . 32.5 m-85 -63.39 -50.11 71.16 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.201 0.524 . . . . 1.78 110.981 178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 17.5 p -66.78 -14.43 62.6 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.321 0.86 . . . . 1.51 113.321 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 94.13 3.43 63.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.689 -0.767 . . . . 1.16 113.184 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.422 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 37.0 m-80 -98.51 68.31 1.83 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.2 -0.296 . . . . 2.22 110.2 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -52.31 119.65 15.47 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.709 -0.678 . . . . 1.75 112.318 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.22 163.38 38.86 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.589 2.859 . . . . 0.71 112.722 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 67.3 p -85.77 173.52 9.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.116 -0.493 . . . . 2.17 109.865 174.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -66.59 -27.83 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.19 -0.67 . . . . 3.31 109.19 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.43 -40.23 93.66 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.286 -0.87 . . . . 2.24 110.782 177.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -59.04 -44.71 91.8 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.876 0.37 . . . . 1.73 110.588 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.66 -46.13 73.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 1.56 110.835 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -55.77 -45.86 78.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.261 0.553 . . . . 2.31 110.101 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -62.07 -43.5 98.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.441 -0.799 . . . . 1.19 111.692 178.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 57.9 p -64.92 -36.2 83.6 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.002 0.371 . . . . 1.84 112.002 -178.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.0 m -78.62 -25.12 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 109.024 -0.732 . . . . 0.66 109.024 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 45.5 mttm -61.53 -45.81 92.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.221 -0.899 . . . . 2.26 111.408 176.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.62 ' O ' HD11 ' A' ' 120' ' ' LEU . 22.3 mm-40 -71.01 -38.7 72.63 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.582 -0.447 . . . . 2.27 110.457 -174.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 m -62.85 -38.5 82.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.483 -0.487 . . . . 0.91 110.265 177.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.492 ' O ' ' HD3' ' A' ' 122' ' ' LYS . 41.2 mt -78.49 -26.68 46.05 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.079 -0.388 . . . . 1.75 111.358 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -61.98 -48.54 79.88 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.525 -0.917 . . . . 1.51 108.525 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.62 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -65.78 -43.82 87.62 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.072 -1.422 . . . . 1.68 111.667 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.658 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 47.7 t80 -72.03 -37.52 69.73 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 120.315 -0.554 . . . . 2.2 111.291 -170.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.492 ' HD3' ' O ' ' A' ' 118' ' ' LEU . 5.8 mptp? -59.75 -31.97 70.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.47 . . . . 2.44 111.052 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.44 -5.68 59.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.593 -0.731 . . . . 1.16 112.608 -174.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -77.39 156.69 31.02 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.048 -0.661 . . . . 1.15 110.389 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.7 t -67.23 152.05 46.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.639 -0.504 . . . . 1.57 109.639 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -54.72 -42.42 71.5 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.814 0.34 . . . . 2.21 111.254 -175.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.04 -30.39 71.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 1.18 111.044 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.92 -37.46 50.49 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.217 -0.753 . . . . 0.35 111.217 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -63.08 -45.63 91.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.195 0.521 . . . . 1.84 109.986 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.59 84.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.426 -0.807 . . . . 1.15 111.41 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 134' ' ' LYS . 24.7 t70 -73.84 -30.63 62.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.292 0.567 . . . . 0.55 109.774 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -64.52 -26.07 68.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.008 -0.542 . . . . 0.49 110.228 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.439 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.96 -14.8 79.99 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 114.243 0.457 . . . . 0.27 114.243 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.57 ' HZ2' ' HB3' ' A' ' 134' ' ' LYS . 0.5 OUTLIER -95.53 -34.18 12.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.518 0.659 . . . . 2.95 111.408 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -89.64 -28.73 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.768 -0.651 . . . . 1.83 110.695 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.66 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 17.2 m-85 -128.9 72.96 81.74 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.296 -0.411 . . . . 0.91 110.168 172.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -61.2 -44.76 22.05 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.832 2.355 . . . . 1.06 112.922 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.51 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 34.8 t80 -66.87 -35.6 80.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 2.9 111.263 -174.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 56.9 mt -74.01 -44.06 55.82 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.614 -0.434 . . . . 1.67 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.439 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -61.15 -32.72 72.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.409 0.623 . . . . 1.04 110.065 176.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.2 tttm -55.18 -70.84 0.09 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.926 -1.034 . . . . 3.06 110.963 171.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.9 m -60.37 -30.29 46.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 112.966 0.728 . . . . 0.5 112.966 -175.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.28 -54.4 14.87 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.248 -0.581 . . . . 0.92 110.657 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -79.22 -19.19 51.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 2.58 112.088 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.1 t -85.48 3.45 40.24 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.992 0.425 . . . . 1.81 110.58 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.4 ' HA2' ' HB2' ' A' ' 149' ' ' ALA . . . 75.54 16.83 80.39 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.803 -0.713 . . . . 1.41 112.804 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -79.45 -62.38 1.71 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.836 0.351 . . . . 2.46 110.112 -178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -70.75 -37.14 73.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.094 -0.503 . . . . 1.07 110.006 176.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.479 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -54.56 -37.45 65.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.284 -0.871 . . . . 1.12 111.82 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -82.8 -23.79 33.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.902 0.382 . . . . 3.27 110.697 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -72.48 -29.16 63.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 0.68 109.823 174.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -86.62 -35.08 19.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.903 -0.589 . . . . 1.18 110.826 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 110.533 -1.027 . . . . 1.62 110.533 -172.355 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.606 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 24.1 p90 . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.148 0.499 . . . . 2.09 110.855 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -105.48 136.12 45.63 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.376 -0.601 . . . . 3.54 109.376 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.625 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 33.9 t80 -65.23 -35.27 80.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.85 0.357 . . . . 2.56 110.737 -177.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -73.1 -5.75 41.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.451 -0.34 . . . . 4.16 111.753 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -87.92 -10.93 49.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.401 0.619 . . . . 2.57 109.848 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 68.1 mt -79.31 134.69 58.42 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.499 -0.926 . . . . 1.31 108.499 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -41.78 113.58 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.184 2.589 . . . . 0.7 112.123 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -17.99 65.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.723 -0.671 . . . . 1.23 111.768 -172.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 7.4 m-20 -65.27 -31.21 72.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.936 0.874 . . . . 1.37 109.426 178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.67 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 75.0 t80 -85.06 -28.89 25.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.036 -1.438 . . . . 1.08 110.313 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 14' ' ' MET . 58.7 mtp180 -72.02 -25.05 61.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.84 0.829 . . . . 2.1 108.849 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -71.53 -18.99 62.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.172 -1.376 . . . . 1.02 110.661 174.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 9' ' ' ASP . 72.1 mt -91.39 -48.48 6.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 1.49 111.124 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 11' ' ' ARG . 17.5 ptp -63.23 133.38 95.43 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 120.979 0.419 . . . . 1.65 109.994 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -74.26 163.81 35.61 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.602 2.201 . . . . 1.12 112.385 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -43.83 -41.74 11.88 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.93 2.42 . . . . 1.3 112.697 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.7 -34.5 18.87 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.438 -0.801 . . . . 2.26 112.122 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.53 -19.25 19.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.717 0.294 . . . . 1.39 111.25 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HG2' ' SD ' ' A' ' 14' ' ' MET . 19.0 mtm180 -88.46 -42.48 12.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.382 -0.372 . . . . 2.54 111.393 -176.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.54 -40.74 60.25 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 123.242 0.339 . . . . 1.06 111.832 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.616 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 32.5 t80 -61.34 -58.97 6.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 119.005 -0.522 . . . . 0.73 111.332 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.5 mt -73.41 -11.92 60.64 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.814 1.188 . . . . 1.75 112.192 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -39.29 83.79 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.622 -0.51 . . . . 2.56 109.622 164.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -69.96 -50.43 41.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.866 -0.607 . . . . 1.84 111.109 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.633 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -59.32 141.97 53.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.31 0.576 . . . . 1.7 111.289 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -141.26 -83.03 0.21 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.491 -0.777 . . . . 2.16 110.456 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.93 158.73 43.8 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.999 -0.741 . . . . 2.39 108.999 176.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.52 -51.4 3.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.894 -0.67 . . . . 1.47 112.833 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -68.75 -43.89 74.87 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.787 -0.243 . . . . 2.25 111.14 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.47 -20.03 62.69 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.0 0.429 . . . . 1.89 111.031 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.3 m -63.74 -39.98 95.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.754 -0.657 . . . . 1.37 110.975 177.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.497 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.7 p -80.85 -27.04 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 116.186 -0.461 . . . . 0.85 110.34 -176.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.57 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.4 mm? -54.49 -56.41 19.11 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.279 -0.419 . . . . 1.65 111.329 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -60.93 -25.23 66.63 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.921 0.341 . . . . 2.89 111.921 -175.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -74.19 -15.4 61.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.969 0.414 . . . . 1.96 111.339 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 82.6 t -90.38 -48.1 14.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.575 0.702 . . . . 0.98 109.317 173.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.624 ' HE2' ' CE1' ' A' ' 37' ' ' PHE . 52.6 m-85 -55.1 -45.09 75.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.637 -1.165 . . . . 1.08 114.018 176.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.12 14.15 5.41 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.952 -0.699 . . . . 2.71 111.557 -176.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.51 -77.25 0.59 Allowed 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.556 -0.747 . . . . 1.57 109.846 173.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.503 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 45.82 -150.72 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.795 -0.716 . . . . 1.54 112.684 -174.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.431 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.3 Cg_endo -91.84 148.99 16.0 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.096 -1.21 . . . . 1.99 111.06 -9.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.503 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 23.4 m-85 -116.79 122.13 43.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.457 0.646 . . . . 1.72 111.067 -171.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.58 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 6.9 ptpp? -88.39 -7.02 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.91 -1.041 . . . . 4.11 109.948 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.548 HD22 ' HG3' ' A' ' 47' ' ' GLU . 8.2 p30 -151.83 162.63 40.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.67 -0.696 . . . . 1.53 109.654 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.9 m -69.38 -32.66 71.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.392 -0.367 . . . . 1.72 111.19 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.438 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 46.3 mt-10 -59.59 -38.33 80.94 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.073 -0.512 . . . . 2.24 111.313 -176.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.58 ' OE1' ' HG2' ' A' ' 43' ' ' LYS . 34.0 mt-10 -57.87 -42.76 85.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.955 0.407 . . . . 2.26 111.403 177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -70.99 -37.48 72.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.141 -0.481 . . . . 1.69 110.148 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 69.9 mt -65.98 -42.65 92.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.088 -0.505 . . . . 1.2 110.093 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.02 75.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.339 -0.846 . . . . 1.29 111.025 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.49 90.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.871 -0.604 . . . . 1.21 110.396 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.431 HD22 HD11 ' A' ' 33' ' ' LEU . 24.9 mt -67.23 -40.76 86.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.135 -0.939 . . . . 1.13 111.174 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.51 -32.68 72.72 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.809 0.338 . . . . 1.87 111.004 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -77.27 -46.8 21.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 3.57 110.596 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.1 mmtt -68.52 -49.46 59.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.024 -0.535 . . . . 2.01 111.858 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 m -147.5 92.26 4.85 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 109.853 -0.425 . . . . 1.68 109.853 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -37.39 -56.75 0.8 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 124.593 3.529 . . . . 0.84 114.096 -172.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.68 -28.89 69.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.409 -0.814 . . . . 2.45 112.148 -175.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 33.8 mt -72.63 -37.9 67.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.755 0.788 . . . . 2.03 109.022 -178.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.27 -36.41 89.6 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 114.526 -1.215 . . . . 0.41 111.229 174.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.578 ' O ' ' HD3' ' A' ' 65' ' ' LYS . . . -61.15 -41.19 96.31 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.348 -0.241 . . . . 1.19 110.348 174.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 42.6 mmtm -50.89 -63.65 1.06 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.261 0.553 . . . . 2.7 110.375 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.2 m -67.49 -27.69 39.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.048 -0.978 . . . . 1.12 111.747 -172.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.15 -45.85 79.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.826 0.346 . . . . 1.7 111.193 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.578 ' HD3' ' O ' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -76.62 -34.88 58.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.742 0.782 . . . . 4.35 109.448 179.184 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.44 -48.11 68.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.593 -1.185 . . . . 2.09 112.047 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -72.93 -25.92 61.21 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.842 -0.799 . . . . 3.07 108.842 -175.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.84 -35.3 80.28 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 114.68 -1.146 . . . . 1.26 111.225 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.402 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 36.4 mtm -62.48 -49.96 73.31 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.139 -0.689 . . . . 1.21 109.139 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.4 t -54.22 -48.81 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 114.707 -1.133 . . . . 0.79 110.268 176.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -63.6 -43.08 97.98 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.485 -0.78 . . . . 2.03 112.403 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.5 m -64.88 -30.53 71.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.855 0.359 . . . . 1.66 111.303 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.5 mtmt -77.79 -36.26 50.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.428 -0.351 . . . . 2.14 110.232 176.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.89 -24.83 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.505 0.669 . . . . 1.1 110.319 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.92 70.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.804 0.811 . . . . 1.18 109.798 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.47 -0.63 57.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.562 -1.199 . . . . 1.11 110.709 -179.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.3 tp -94.79 135.48 36.23 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.851 -0.613 . . . . 1.34 109.944 -178.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.44 144.43 48.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.929 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -33.8 -43.3 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 125.067 3.845 . . . . 1.89 115.199 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -64.76 -52.73 55.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.941 0.4 . . . . 2.52 110.591 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.5 -31.55 53.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.41 0.624 . . . . 1.13 109.946 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -57.84 -46.26 85.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.772 -1.104 . . . . 2.52 111.118 176.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.91 -40.2 98.54 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.648 -0.787 . . . . 0.46 111.574 177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -65.3 -46.57 79.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.603 -0.299 . . . . 2.04 110.804 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.35 -46.0 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.039 0.447 . . . . 1.07 111.198 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -60.04 -38.42 82.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.3 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.3 tmtp? -77.61 -46.45 22.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.123 -0.231 . . . . 2.74 110.65 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 p -63.37 -43.05 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.753 0.311 . . . . 0.65 111.165 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -62.03 -40.36 87.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 1.79 110.354 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -66.76 -35.52 80.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.493 -0.321 . . . . 2.82 111.42 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 94.8 mt -63.87 -45.72 96.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.723 0.297 . . . . 1.2 110.513 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.675 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -64.95 -42.44 94.62 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.697 -0.482 . . . . 1.23 109.697 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -59.48 -34.06 72.09 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.556 -0.747 . . . . 5.02 111.265 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.69 -39.55 86.13 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.958 -0.639 . . . . 0.72 112.287 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.446 HD12 ' OG ' ' A' ' 113' ' ' SER . 29.6 mm -66.45 -49.67 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.166 0.508 . . . . 1.23 109.672 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.921 ' HZ2' ' HH ' ' A' ' 100' ' ' TYR . 14.5 ptmm? -83.87 36.01 0.54 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.61 0.719 . . . . 3.16 110.114 175.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.1 -32.92 3.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.949 -1.023 . . . . 1.33 109.842 165.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -88.0 -3.48 58.9 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.137 -0.483 . . . . 3.64 110.315 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.434 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 28.2 m-85 -88.32 -31.23 19.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.16 0.505 . . . . 1.28 109.778 166.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.921 ' HH ' ' HZ2' ' A' ' 96' ' ' LYS . 4.5 m-85 -66.74 -34.57 78.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.722 -0.672 . . . . 1.78 111.765 -176.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 p -73.63 -0.42 15.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.756 -0.657 . . . . 1.51 112.644 -174.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.86 9.48 64.03 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.688 -0.768 . . . . 1.16 111.945 -175.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -105.28 177.3 4.89 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.851 -0.426 . . . . 2.22 109.851 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -141.59 100.65 6.13 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.611 -0.268 . . . . 1.75 111.396 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 9.6 Cg_endo -56.96 132.83 54.07 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 121.987 1.791 . . . . 0.71 110.078 167.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -76.03 173.51 11.18 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.313 -0.555 . . . . 2.17 110.157 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 86.0 tttt -60.13 -33.12 71.71 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.767 -0.373 . . . . 3.31 110.366 -175.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -58.32 -40.87 83.2 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.819 -0.628 . . . . 2.24 110.864 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.02 -47.55 84.8 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.124 -0.489 . . . . 1.73 110.544 177.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.7 mp -65.4 -45.98 81.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.715 -0.675 . . . . 1.56 110.713 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 151' ' ' PHE . 59.9 mtpt -55.16 -51.32 66.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.03 0.443 . . . . 2.31 110.481 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.54 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -60.96 -41.26 96.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.543 -0.753 . . . . 1.19 111.2 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.446 ' OG ' HD12 ' A' ' 95' ' ' ILE . 50.4 m -65.13 -43.08 93.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.216 -0.447 . . . . 1.84 112.04 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.461 ' O ' ' HB ' ' A' ' 117' ' ' VAL . 10.2 m -76.15 -29.88 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.596 0.712 . . . . 0.66 109.646 -176.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.4 ptmt -72.47 -26.11 61.68 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.13 -0.941 . . . . 2.26 110.624 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.523 ' O ' HD11 ' A' ' 120' ' ' LEU . 4.8 tt0 -76.83 -33.7 57.93 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 109.262 -0.644 . . . . 2.27 109.262 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 114' ' ' VAL . 93.6 t -58.42 -47.72 87.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.424 0.63 . . . . 0.91 110.198 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.575 ' O ' ' HG3' ' A' ' 122' ' ' LYS . 7.7 mt -69.41 -26.14 64.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.62 -0.718 . . . . 1.75 110.37 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 34.3 ttpt -62.62 -43.99 97.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.677 -0.86 . . . . 1.51 108.677 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.523 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.77 -45.95 66.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.839 -1.073 . . . . 1.68 111.841 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.67 ' HD2' ' CD1' ' A' ' 121' ' ' TYR . 0.0 OUTLIER -71.5 -36.12 70.99 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 118.929 -1.108 . . . . 2.2 111.833 -168.652 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 29.8 mttp -64.39 -30.3 71.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.057 0.456 . . . . 2.44 110.49 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -6.38 58.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 1.16 112.352 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.6 mtm -77.37 158.38 30.13 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.224 -0.591 . . . . 1.15 110.317 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.5 m -65.15 152.11 44.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.338 -0.245 . . . . 1.57 110.338 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -57.18 -42.15 80.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.725 0.298 . . . . 2.21 111.181 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.2 -29.65 70.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 1.18 110.956 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.25 -38.66 53.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.942 -0.572 . . . . 0.35 111.932 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -61.51 -45.54 93.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.474 0.654 . . . . 1.84 109.514 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.18 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.05 -0.977 . . . . 1.15 110.966 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -74.24 -34.35 63.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.047 -0.524 . . . . 0.55 109.669 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.06 -34.03 76.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.722 -0.672 . . . . 0.49 110.098 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.412 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -63.9 -22.3 66.4 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.94 -0.573 . . . . 0.27 113.318 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.513 ' HB2' ' HZ1' ' A' ' 134' ' ' LYS . 10.3 mtmp? -85.81 -19.38 30.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 2.95 111.386 -178.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -105.45 -37.2 6.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 1.83 110.991 -177.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.636 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 77.8 m-85 -129.23 73.58 81.59 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.932 0.396 . . . . 0.91 110.059 175.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.47 -30.78 72.08 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.885 2.39 . . . . 1.06 112.388 -175.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.654 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 36.2 t80 -69.63 -39.53 77.09 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.439 . . . . 2.9 110.242 -178.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.458 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 71.0 mt -77.62 -44.14 29.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.301 -0.408 . . . . 1.67 110.75 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.412 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.29 -39.03 74.91 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.744 -0.465 . . . . 1.04 109.744 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.2 tttt -45.62 -71.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.04 -0.982 . . . . 3.06 111.444 171.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -67.06 -25.24 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.489 -0.778 . . . . 0.5 112.706 -172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.458 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 23.0 m-30 -75.03 -54.52 7.02 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.755 -0.778 . . . . 0.92 110.125 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -64.69 -31.3 72.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 2.58 111.777 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 15.7 m -84.9 0.19 51.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.794 0.33 . . . . 1.81 111.471 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.97 79.06 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.774 -0.727 . . . . 1.41 112.648 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -69.43 -47.33 64.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.94 0.4 . . . . 2.46 110.102 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.95 -30.49 61.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.149 -0.478 . . . . 1.07 110.589 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.417 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -58.58 -39.55 80.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 1.12 111.725 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -79.87 -29.54 40.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.78 -0.368 . . . . 3.27 110.8 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 111' ' ' LYS . 66.7 t80 -66.56 -33.01 74.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.177 0.513 . . . . 0.68 109.656 172.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.485 ' HB2' ' CB ' ' A' ' 115' ' ' LYS . . . -67.74 -25.59 65.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.349 -0.841 . . . . 1.18 111.03 177.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.61 0 CA-C-N 115.558 -0.746 . . . . 1.62 112.013 -179.989 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.649 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 3.2 p90 . . . . . 0 C--O 1.237 0.421 0 N-CA-C 109.821 -0.437 . . . . 2.09 109.821 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -105.7 149.45 26.37 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.968 -0.382 . . . . 3.54 109.968 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.654 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 25.3 t80 -54.47 -45.55 73.2 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.921 0.391 . . . . 2.56 111.233 -178.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.54 16.34 1.39 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.477 0.547 . . . . 4.16 112.477 -176.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -86.12 -8.56 57.78 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.647 -0.872 . . . . 2.57 108.647 171.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.8 mt -85.62 129.27 55.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.947 -1.024 . . . . 1.31 109.0 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -42.34 114.77 0.42 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.311 2.674 . . . . 0.7 112.442 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.61 -23.96 65.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.82 -0.627 . . . . 1.23 111.928 -174.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.32 -35.94 82.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.724 0.773 . . . . 1.37 110.022 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.652 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 40.5 t80 -82.16 -20.24 38.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.655 -1.157 . . . . 1.08 110.945 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.667 ' HE ' ' HH ' ' A' ' 3' ' ' TYR . 56.0 mtp180 -72.35 -20.24 61.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.266 -0.642 . . . . 2.1 109.266 176.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.71 -23.69 58.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.844 -1.071 . . . . 1.02 109.745 174.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.404 HD12 ' HG2' ' A' ' 147' ' ' LYS . 10.0 mp -83.6 -44.28 14.76 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 114.998 -1.001 . . . . 1.49 110.33 173.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.502 ' SD ' ' HE3' ' A' ' 96' ' ' LYS . 46.4 ttp -68.14 128.7 93.22 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.111 -0.949 . . . . 1.65 111.443 -173.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.89 149.61 89.3 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.142 2.561 . . . . 1.12 112.808 -175.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -51.89 -27.95 29.58 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.096 3.197 . . . . 1.3 113.04 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -64.48 -57.42 9.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.26 0.553 . . . . 2.26 109.584 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 -28.33 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.797 -0.638 . . . . 1.39 110.577 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -68.89 -40.72 79.03 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.8 -0.636 . . . . 2.54 110.758 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.67 -53.1 60.7 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.378 0.511 . . . . 1.06 112.378 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 69.1 t80 -57.21 -41.78 80.1 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.458 0.54 . . . . 0.73 112.458 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.53 HD23 ' HH ' ' A' ' 100' ' ' TYR . 91.6 mt -88.85 -13.79 38.41 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 118.955 0.798 . . . . 1.75 111.402 177.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.45 -42.39 92.4 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.241 -0.652 . . . . 2.56 109.241 164.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -68.1 -53.24 26.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.331 -0.849 . . . . 1.84 111.26 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 14.0 mt -56.17 129.91 42.08 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.545 0.688 . . . . 1.7 111.12 -177.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 m -143.47 -83.43 0.16 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.797 -1.092 . . . . 2.16 110.926 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.4 142.87 44.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.522 -0.308 . . . . 2.39 110.651 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.81 -45.1 3.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.946 -0.645 . . . . 1.47 112.959 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -57.02 -47.32 81.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 2.25 110.696 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 mmtm -57.08 -31.21 65.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.833 -0.621 . . . . 1.89 111.35 -174.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -67.8 -32.05 72.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.585 . . . . 1.37 111.473 -178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.482 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 4.7 p -95.18 -28.05 4.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.048 -0.523 . . . . 0.85 111.722 -172.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.412 HD13 ' HE2' ' A' ' 37' ' ' PHE . 4.0 mm? -55.8 -45.95 78.13 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.707 0.262 . . . . 1.65 111.707 175.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -62.15 -30.44 71.05 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.66 0.266 . . . . 2.89 111.303 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -69.51 -37.06 77.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.331 -0.395 . . . . 1.96 110.611 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 86.8 t -71.97 -51.88 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.5 0.666 . . . . 0.98 110.233 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.704 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 24.0 m-85 -59.93 -41.47 91.84 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.068 1.507 . . . . 1.08 115.068 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -80.25 2.18 25.53 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.628 -0.829 . . . . 2.71 111.293 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -98.07 -80.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.708 -0.678 . . . . 1.57 109.623 172.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.475 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.44 -157.98 0.63 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.761 -0.733 . . . . 1.54 112.96 -172.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -93.88 153.29 14.77 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.042 -1.232 . . . . 1.99 111.49 -7.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.475 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 25.7 m-85 -117.41 132.22 56.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.032 -0.531 . . . . 1.72 110.864 -173.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.442 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 22.2 pttp -87.91 -12.71 43.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.481 -0.781 . . . . 4.11 109.907 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.503 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -159.84 151.79 20.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.617 -0.719 . . . . 1.53 109.532 -179.308 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.8 m -60.1 -22.02 62.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.615 . . . . 1.72 112.037 -174.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.02 -40.24 80.33 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.816 0.341 . . . . 2.24 110.801 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.503 ' HG3' HD22 ' A' ' 44' ' ' ASN . 46.3 mt-10 -64.77 -31.51 72.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 2.26 111.086 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.3 t -75.61 -37.63 59.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 1.69 109.831 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.11 -42.89 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 1.2 109.655 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.06 -49.28 76.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.047 -0.979 . . . . 1.29 111.361 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.85 95.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.848 -0.614 . . . . 1.21 110.669 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.28 -35.41 76.02 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 115.443 -0.799 . . . . 1.13 111.43 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -65.39 -36.61 84.48 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.028 0.442 . . . . 1.87 110.814 175.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -66.75 -50.15 63.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 3.57 110.363 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.482 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 43.0 mmtt -66.55 -55.34 15.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 2.01 111.915 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.6 t -139.92 95.47 8.62 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 110.199 -0.297 . . . . 1.68 110.199 -175.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.16 -58.94 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.922 3.081 . . . . 0.84 113.424 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.35 -29.49 70.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.231 -0.895 . . . . 2.45 112.064 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.83 -40.6 68.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.28 -1.007 . . . . 2.03 108.28 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.99 -31.39 78.42 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.41 111.683 175.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.12 -43.08 68.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.28 -0.267 . . . . 1.19 110.28 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -58.68 -45.16 90.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.255 -0.43 . . . . 2.7 111.323 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.41 -33.3 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.284 . . . . 1.12 111.121 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.03 -52.72 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.657 -0.247 . . . . 1.7 111.152 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -59.52 -36.49 76.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.43 0.633 . . . . 4.35 110.153 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.475 HD11 ' C ' ' A' ' 66' ' ' LEU . 2.4 tm? -66.44 -45.95 78.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.896 -1.047 . . . . 2.09 110.461 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -77.0 -27.62 54.73 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.357 -0.609 . . . . 3.07 109.357 -171.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.91 96.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.223 -0.899 . . . . 1.26 111.461 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 49.6 mtm -59.37 -51.3 70.49 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.712 0.768 . . . . 1.21 109.32 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.6 t -52.41 -48.32 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 CA-C-N 114.121 -1.4 . . . . 0.79 110.474 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.411 ' HB3' ' HE2' ' A' ' 71' ' ' LYS . 9.5 mmmm -61.6 -41.15 97.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.422 -0.808 . . . . 2.03 111.814 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 t -58.7 -40.68 84.32 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.093 0.473 . . . . 1.66 110.787 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.8 mttm -74.01 -41.69 61.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.905 -0.588 . . . . 2.14 110.691 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.431 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 64.2 mt -68.2 -24.5 30.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.379 0.609 . . . . 1.1 110.662 177.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -39.66 71.56 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.667 -0.697 . . . . 1.18 109.969 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.83 -46.52 62.58 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.939 -1.028 . . . . 1.11 109.973 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.444 HD11 ' CG ' ' A' ' 135' ' ' GLN . 7.1 tp -40.62 132.68 2.12 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 114.858 -1.064 . . . . 1.34 112.723 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 159.71 49.34 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.562 -0.745 . . . . 0.76 112.306 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -46.83 -41.12 25.32 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.795 2.997 . . . . 1.89 113.722 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.4 -53.81 46.51 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.266 0.555 . . . . 2.52 110.393 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.546 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -78.02 -29.13 49.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.731 -0.668 . . . . 1.13 111.099 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.431 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 25.8 ttpp -58.01 -42.52 85.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.722 -0.672 . . . . 2.52 110.53 176.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.35 -42.53 98.9 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.732 -0.747 . . . . 0.46 111.676 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.445 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.6 t80 -65.94 -46.06 79.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.445 0.164 . . . . 2.04 110.962 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.019 0.437 . . . . 1.07 111.363 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.93 -23.37 65.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 1.96 111.209 -176.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -85.93 -49.81 7.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.448 -0.342 . . . . 2.74 110.942 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.3 p -62.21 -40.71 97.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.327 -0.397 . . . . 0.65 111.272 -176.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 43.5 mt -62.11 -37.15 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 116.172 -0.467 . . . . 1.79 111.322 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -69.59 -36.71 76.48 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.768 -0.373 . . . . 2.82 110.717 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.11 -48.85 86.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.325 0.584 . . . . 1.2 109.801 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.8 68.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.592 -0.731 . . . . 1.23 111.1 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.2 -41.41 99.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 5.02 110.133 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.432 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -67.45 -32.45 79.17 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.059 -0.591 . . . . 0.72 112.409 -177.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mm -61.13 -43.32 96.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.0 0.429 . . . . 1.23 110.911 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.502 ' HE3' ' SD ' ' A' ' 14' ' ' MET . 3.5 mppt? -100.57 15.79 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.002 0.43 . . . . 3.16 110.529 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.704 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -93.34 -31.1 14.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.661 -0.699 . . . . 1.33 109.22 168.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.567 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 14.4 ptm180 -86.36 -1.49 57.58 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.842 -0.617 . . . . 3.64 109.941 173.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -81.16 -26.76 35.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.037 -0.727 . . . . 1.28 109.037 164.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.663 ' HD2' ' CD1' ' A' ' 100' ' ' TYR . 24.0 m-85 -75.18 -48.89 21.37 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.404 0.621 . . . . 1.78 110.353 177.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.567 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 26.7 p -67.43 -15.6 63.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.51 112.906 -173.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.12 32.84 10.13 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.821 -0.704 . . . . 1.16 112.401 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.66 61.71 1.4 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.705 -0.48 . . . . 2.22 109.705 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 104' ' ' GLU . 4.8 mp0 -45.5 119.67 4.53 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-N 115.205 -0.907 . . . . 1.75 111.999 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.7 153.63 75.47 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.57 2.18 . . . . 0.71 111.629 175.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.403 HG21 ' H ' ' A' ' 108' ' ' ASP . 9.1 t -93.35 175.71 6.66 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.564 -0.902 . . . . 2.17 108.564 173.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 31.5 mtmt -62.71 -33.8 75.85 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.487 -0.485 . . . . 3.31 110.199 -175.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.403 ' H ' HG21 ' A' ' 106' ' ' THR . 3.4 m-20 -58.95 -38.65 79.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.455 -0.793 . . . . 2.24 111.197 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -61.23 -44.16 97.71 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.023 -0.362 . . . . 1.73 110.023 178.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.403 ' HA ' ' OG ' ' A' ' 113' ' ' SER . 10.3 mp -67.59 -42.66 82.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.753 -0.658 . . . . 1.56 110.749 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.9 mtpm? -55.61 -48.19 75.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.258 0.551 . . . . 2.31 110.325 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.48 93.06 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.31 -0.859 . . . . 1.19 111.412 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.403 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 79.5 p -64.79 -38.38 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.172 0.434 . . . . 1.84 112.172 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.475 ' O ' HD21 ' A' ' 118' ' ' LEU . 13.7 m -77.6 -23.65 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.847 0.832 . . . . 0.66 109.362 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HA ' ' HB3' ' A' ' 152' ' ' ALA . 52.3 tttm -63.96 -41.14 97.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.778 -1.101 . . . . 2.26 110.987 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 18.1 mm-40 -72.32 -33.71 67.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.583 -0.447 . . . . 2.27 110.608 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 m -68.44 -34.41 65.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.546 -0.462 . . . . 0.91 110.676 177.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.475 HD21 ' O ' ' A' ' 114' ' ' VAL . 3.1 mm? -70.7 -33.24 70.68 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.926 -0.484 . . . . 1.75 109.963 173.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.4 ttpt -60.71 -46.02 91.97 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.146 -0.687 . . . . 1.51 109.146 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.93 -47.82 60.89 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.963 -1.017 . . . . 1.68 111.804 175.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.609 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 70.3 t80 -70.18 -35.82 74.23 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.872 -0.731 . . . . 2.2 111.745 -167.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 75.4 mttt -67.59 -27.32 66.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.884 0.373 . . . . 2.44 111.088 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.96 -7.58 58.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.944 -0.571 . . . . 1.16 112.43 -176.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.546 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 41.2 mtm -75.68 159.25 31.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.433 -0.507 . . . . 1.15 111.047 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 m -63.43 143.33 57.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.359 -0.382 . . . . 1.57 110.66 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -56.32 -46.23 79.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.607 0.241 . . . . 2.21 111.425 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.51 74.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.004 0.431 . . . . 1.18 110.949 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.77 -35.77 58.43 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.683 -0.69 . . . . 0.35 111.761 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -66.71 -42.18 86.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.345 0.593 . . . . 1.84 110.071 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.55 -29.88 68.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 1.15 110.687 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -76.19 -32.33 58.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.227 0.537 . . . . 0.55 109.785 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.408 ' HA ' HD12 ' A' ' 77' ' ' LEU . 86.6 t80 -61.6 -30.91 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.49 109.698 171.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . 0.448 ' O ' ' HB3' ' A' ' 137' ' ' PRO . . . -75.7 0.69 60.59 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.759 -0.655 . . . . 0.27 112.724 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -99.07 -28.99 13.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.581 0.705 . . . . 2.95 109.584 175.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 50.4 mm-40 -97.95 -42.28 7.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.136 -0.938 . . . . 1.83 110.147 -176.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.615 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 65.6 m-85 -135.22 70.59 68.65 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.162 -0.472 . . . . 0.91 110.11 176.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . 0.448 ' HB3' ' O ' ' A' ' 133' ' ' GLY . 36.8 Cg_endo -65.88 -19.84 58.39 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.864 2.376 . . . . 1.06 112.632 -176.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.522 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 23.1 t80 -65.86 -37.82 87.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.378 -0.374 . . . . 2.9 110.564 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.599 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -78.46 -44.71 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.905 -0.405 . . . . 1.67 109.905 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.15 -32.66 66.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.456 0.646 . . . . 1.04 109.961 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.5 tttt -54.5 -74.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.563 -1.199 . . . . 3.06 111.155 170.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.97 -28.21 43.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 112.944 0.72 . . . . 0.5 112.944 -173.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.599 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 19.7 m-30 -66.32 -55.28 16.73 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.517 -0.473 . . . . 0.92 110.139 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.9 -27.89 60.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.325 -0.852 . . . . 2.58 111.383 -175.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 35.6 t -63.89 -26.95 68.83 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.531 -0.544 . . . . 1.81 109.531 174.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 104.47 -5.02 44.02 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.818 -0.706 . . . . 1.41 112.557 177.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.404 ' HG2' HD12 ' A' ' 13' ' ' LEU . 51.7 tttp -62.74 -56.33 18.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.789 0.328 . . . . 2.46 111.084 -176.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -62.79 -36.49 83.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 1.07 110.632 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -57.0 -51.26 69.97 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.184 -0.462 . . . . 1.12 110.668 175.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 73.0 mmtt -59.95 -42.71 94.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.369 -0.378 . . . . 3.27 111.007 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.653 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 26.1 t80 -59.95 -35.16 74.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.437 0.637 . . . . 0.68 110.043 177.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' A' ' 115' ' ' LYS . . . -77.34 -7.99 56.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.565 -0.743 . . . . 1.18 111.891 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.191 0 C-N-CA 120.895 -0.669 . . . . 1.62 111.771 -176.264 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.637 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 2.2 p90 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-O 121.293 0.568 . . . . 2.09 109.628 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.413 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 3.3 mmmp? -117.62 -173.43 2.42 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 3.54 109.818 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.631 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 77.5 t80 -69.62 -38.95 77.42 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.584 -0.895 . . . . 2.56 108.584 173.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.413 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 1.7 mp0 -63.59 -26.21 68.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.487 -1.233 . . . . 4.16 111.628 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -78.43 -17.83 55.82 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.898 0.38 . . . . 2.57 110.969 -176.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.78 126.12 78.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 108.412 -0.959 . . . . 1.31 108.412 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -42.12 114.05 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.328 2.685 . . . . 0.7 113.041 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.43 -25.73 62.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.479 -0.782 . . . . 1.23 111.792 -176.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -62.27 -38.73 90.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 122.043 0.925 . . . . 1.37 109.677 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.646 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 47.8 t80 -80.94 -33.8 33.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.117 -1.401 . . . . 1.08 111.238 -178.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -66.48 -22.62 66.19 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.509 0.671 . . . . 2.1 109.235 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -72.85 -10.34 59.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.485 -1.234 . . . . 1.02 111.631 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -100.64 -42.33 6.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.689 0.281 . . . . 1.49 111.55 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.448 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 25.9 ptt? -76.03 144.2 75.26 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.988 0.423 . . . . 1.65 110.962 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.35 156.05 55.12 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.133 2.555 . . . . 1.12 113.623 -172.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -42.41 -47.57 7.28 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.735 2.957 . . . . 1.3 114.262 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.544 ' O ' HD22 ' A' ' 66' ' ' LEU . 1.6 pm0 -56.56 -45.41 81.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.788 0.267 . . . . 2.26 111.687 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.37 -16.04 62.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.191 0.52 . . . . 1.39 110.992 -178.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HE ' ' HH ' ' A' ' 3' ' ' TYR . 32.0 mtp180 -90.98 -32.31 16.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.795 -0.639 . . . . 2.54 110.076 177.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 18.0 t70 -56.26 -49.32 74.54 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.67 -0.696 . . . . 1.06 111.86 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.652 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 60.1 t80 -54.45 -57.54 10.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.43 -0.35 . . . . 0.73 111.349 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 1.025 HD22 ' HH ' ' A' ' 100' ' ' TYR . 88.6 mt -78.08 -6.69 55.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 119.06 0.846 . . . . 1.75 112.062 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 29.9 tt0 -68.66 -34.67 76.09 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.009 0.433 . . . . 2.56 110.077 163.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -77.93 -54.48 6.26 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.176 -0.466 . . . . 1.84 110.954 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.577 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.3 mm? -55.27 132.02 46.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 1.7 110.488 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.5 m -137.37 -88.0 0.28 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 120.507 -0.477 . . . . 2.16 112.206 -172.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -132.58 119.41 20.45 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.898 0.38 . . . . 2.39 111.096 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.62 -46.94 1.07 Allowed Glycine 0 CA--C 1.542 1.765 0 N-CA-C 115.459 0.944 . . . . 1.47 115.459 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.2 -6.84 40.72 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.206 1.558 . . . . 2.25 115.206 -170.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.807 ' HD3' ' CE1' ' A' ' 1' ' ' PHE . 90.7 mttt -80.59 -15.89 55.49 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.024 -1.102 . . . . 1.89 108.024 171.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -61.2 -31.59 71.36 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.567 -1.197 . . . . 1.37 110.235 175.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.495 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 7.5 p -89.95 -23.98 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 115.983 -0.553 . . . . 0.85 110.594 -178.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 30' ' ' LYS . 3.7 mm? -54.3 -52.41 61.57 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.194 0.198 . . . . 1.65 111.065 170.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -62.11 -29.59 70.44 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.681 0.277 . . . . 2.89 111.235 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.69 -41.89 99.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.04 -0.527 . . . . 1.96 110.348 175.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.7 t -68.42 -49.68 63.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.295 0.569 . . . . 0.98 110.147 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.676 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 28.0 m-85 -55.4 -49.32 72.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 114.138 1.162 . . . . 1.08 114.138 177.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -77.38 -5.46 49.77 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.937 -0.705 . . . . 2.71 111.262 -174.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -90.02 -76.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.942 -0.572 . . . . 1.57 109.559 169.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.63 -155.34 1.55 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.299 -0.476 . . . . 1.54 112.881 -175.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -98.49 154.65 7.43 Favored 'Cis proline' 0 N--CA 1.454 -0.826 0 CA-C-N 118.472 1.136 . . . . 1.99 111.938 -7.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.8 124.78 50.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.176 0.513 . . . . 1.72 110.71 -175.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -89.79 -13.62 36.28 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.684 -0.858 . . . . 4.11 108.684 171.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.598 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.1 p30 -148.69 149.87 32.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.831 -1.077 . . . . 1.53 108.51 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 t -70.31 -16.28 62.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.004 0.431 . . . . 1.72 110.887 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.598 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 32.3 tt0 -60.13 -36.73 78.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.933 -0.576 . . . . 2.24 110.267 175.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -60.88 -38.85 87.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.212 -0.449 . . . . 2.26 111.051 177.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.5 t -64.97 -41.7 95.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.229 -0.442 . . . . 1.69 110.11 178.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.492 HD12 ' ND1' ' A' ' 67' ' ' HIS . 78.0 mt -66.28 -48.4 81.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.192 -0.458 . . . . 1.2 110.641 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.53 76.44 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.577 -0.738 . . . . 1.29 111.899 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.83 -38.64 82.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.171 0.51 . . . . 1.21 110.738 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.424 HD22 HD11 ' A' ' 33' ' ' LEU . 20.2 mt -72.6 -33.46 66.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.669 -0.696 . . . . 1.13 111.462 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -66.29 -26.38 67.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.031 0.443 . . . . 1.87 110.833 175.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -77.44 -50.21 13.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.759 -0.655 . . . . 3.57 110.532 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 33.7 mmtt -65.38 -59.87 3.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.601 -0.727 . . . . 2.01 111.981 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.6 t -138.51 99.41 8.66 Favored Pre-proline 0 C--N 1.316 -0.869 0 C-N-CA 120.472 -0.491 . . . . 1.68 110.811 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -40.3 -57.95 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.944 3.096 . . . . 0.84 113.176 -172.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -56.59 -35.61 68.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.49 -1.232 . . . . 2.45 111.933 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.9 mt -76.11 -41.32 50.61 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 119.575 -0.85 . . . . 2.03 109.23 -174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.58 -35.14 90.68 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.42 -1.263 . . . . 0.41 111.801 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.6 68.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.92 0.39 . . . . 1.19 110.425 174.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 2.7 tppt? -67.22 -47.4 70.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.948 -0.569 . . . . 2.7 110.768 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.4 p -69.65 -26.7 31.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.182 0.515 . . . . 1.12 110.376 176.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -64.56 -52.98 54.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.63 -0.714 . . . . 1.7 110.954 176.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 45.3 pttt -65.7 -30.59 71.3 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.727 -0.842 . . . . 4.35 108.727 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.95 -0.03 12.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 114.391 -1.277 . . . . 2.09 110.389 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.492 ' ND1' HD12 ' A' ' 49' ' ' ILE . 13.5 m80 -113.64 -48.25 2.94 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 115.843 -0.617 . . . . 3.07 110.201 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.55 76.85 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.173 0.434 . . . . 1.26 112.173 -178.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 44.0 mtm -66.63 -47.7 71.76 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.239 0.542 . . . . 1.21 110.433 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.8 t -62.31 -41.85 93.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.424 -0.807 . . . . 0.79 110.161 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 mmmm -63.26 -30.78 71.85 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 115.157 -0.929 . . . . 2.03 111.417 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 40.7 t -62.37 -43.31 99.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.289 0.566 . . . . 1.66 110.553 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -69.54 -39.02 77.7 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.343 -0.614 . . . . 2.14 109.343 177.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.515 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 75.1 mt -77.16 -14.37 14.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.652 0.739 . . . . 1.1 111.148 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.74 -34.32 27.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.831 0.824 . . . . 1.18 109.325 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.65 -0.68 57.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.972 -1.467 . . . . 1.11 110.084 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.407 HD13 ' OD2' ' A' ' 131' ' ' ASP . 13.6 tp -91.4 138.39 31.62 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.462 -0.79 . . . . 1.34 109.827 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.08 151.23 27.18 Favored Glycine 0 C--O 1.227 -0.3 0 CA-C-N 115.928 -0.578 . . . . 0.76 112.537 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -43.52 -42.72 11.05 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.921 3.081 . . . . 1.89 114.179 -176.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 0.3 OUTLIER -81.02 -41.89 21.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.592 -0.276 . . . . 2.52 111.417 -177.085 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.22 82.3 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.568 0.699 . . . . 1.13 109.935 178.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.515 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 28.6 ttpp -53.54 -48.22 69.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.596 -1.184 . . . . 2.52 111.389 174.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.7 -39.69 91.6 Favored Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.798 -0.715 . . . . 0.46 112.191 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -67.34 -46.63 72.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.643 0.258 . . . . 2.04 110.869 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.01 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.088 0.471 . . . . 1.07 111.413 -177.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 41.2 mt-10 -65.71 -23.94 66.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.768 -0.651 . . . . 1.96 111.492 -176.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -93.98 -42.72 8.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 116.736 -0.211 . . . . 2.74 111.359 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.3 p -60.38 -45.08 94.8 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.737 0.304 . . . . 0.65 111.037 -177.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.578 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 1.7 mp -56.49 -40.13 66.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 1.79 110.481 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -74.74 -35.08 62.63 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.121 0.415 . . . . 2.82 112.121 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.4 mt -63.84 -48.26 87.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.034 0.445 . . . . 1.2 109.834 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.7 -30.03 70.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.699 -0.682 . . . . 1.23 110.712 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 11.5 ttt85 -70.49 -40.58 73.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.302 -0.863 . . . . 5.02 110.67 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.71 -32.29 83.67 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 121.255 -0.498 . . . . 0.72 112.328 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.7 mm -62.63 -44.53 99.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.275 0.559 . . . . 1.23 110.715 177.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 36.7 mtmm -91.74 8.85 35.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.903 -0.59 . . . . 3.16 110.275 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.676 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -97.02 -33.15 11.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.781 -0.645 . . . . 1.33 109.61 171.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.411 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 13.8 ptp180 -83.51 -3.34 57.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.161 -0.681 . . . . 3.64 109.161 172.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.507 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.112 -0.699 . . . . 1.28 109.112 164.345 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.636 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 26.9 m-85 -70.17 -48.53 56.87 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.033 -0.53 . . . . 1.78 110.97 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.411 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.5 p -62.15 -19.97 63.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.289 -0.869 . . . . 1.51 112.722 -173.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.39 1.72 40.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.695 -0.764 . . . . 1.16 112.208 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -101.41 60.32 0.9 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.648 -0.501 . . . . 2.22 109.648 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -50.77 116.11 6.64 Favored Pre-proline 0 C--O 1.234 0.251 0 O-C-N 123.817 0.698 . . . . 1.75 111.691 -173.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.57 157.16 56.81 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 123.49 2.793 . . . . 0.71 113.324 -174.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.407 ' O ' HD11 ' A' ' 110' ' ' LEU . 75.3 p -87.86 178.0 6.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.524 -0.307 . . . . 2.17 110.31 174.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.64 -25.49 65.76 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.126 0.489 . . . . 3.31 109.972 175.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.474 ' HA ' ' HG2' ' A' ' 111' ' ' LYS . 23.3 m-20 -71.11 -30.84 67.03 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.917 -0.583 . . . . 2.24 110.541 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.15 -46.48 80.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.19 0.519 . . . . 1.73 109.802 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.407 HD11 ' O ' ' A' ' 106' ' ' THR . 10.2 mp -64.91 -47.89 76.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.601 -0.727 . . . . 1.56 111.691 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.474 ' HG2' ' HA ' ' A' ' 108' ' ' ASP . 16.0 ptpt -60.89 -38.5 85.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.912 0.387 . . . . 2.31 110.283 -177.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.21 75.27 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.926 -0.579 . . . . 1.19 111.229 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.7 t -55.33 -48.01 74.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.986 -0.552 . . . . 1.84 110.925 178.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.6 m -77.29 -28.04 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.547 0.689 . . . . 0.66 109.534 -176.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 22.2 ttmm -59.11 -44.82 92.01 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.208 -0.905 . . . . 2.26 111.675 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.467 ' O ' HD11 ' A' ' 120' ' ' LEU . 20.3 mt-10 -71.14 -34.32 70.9 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.026 -0.67 . . . . 2.27 111.253 -176.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 m -68.89 -22.41 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 C-N-CA 120.365 -0.534 . . . . 0.91 109.728 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.437 HD11 ' HA ' ' A' ' 149' ' ' ALA . 22.0 mt -83.44 -36.82 23.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.483 -0.326 . . . . 1.75 110.485 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.62 -39.53 80.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.615 0.722 . . . . 1.51 109.293 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.467 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -73.11 -48.74 33.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.896 -1.047 . . . . 1.68 112.165 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.649 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 0.0 OUTLIER -70.59 -35.52 73.07 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 119.011 -1.075 . . . . 2.2 111.234 -168.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.82 ' HZ2' ' HH ' ' A' ' 121' ' ' TYR . 72.0 mmtt -61.72 -33.12 73.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.006 0.431 . . . . 2.44 110.59 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.09 -1.7 57.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 1.16 112.464 -176.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.56 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 50.8 mtm -74.82 157.81 34.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.333 -0.547 . . . . 1.15 111.076 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.5 m -63.21 149.08 46.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.148 -0.478 . . . . 1.57 110.368 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -59.34 -43.28 92.78 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.543 0.211 . . . . 2.21 111.534 -174.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.41 -25.96 68.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.836 0.35 . . . . 1.18 111.046 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.76 -36.79 31.85 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.801 -0.714 . . . . 0.35 111.608 177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 124' ' ' MET . 97.5 mttt -65.46 -45.57 83.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.449 0.643 . . . . 1.84 110.014 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.31 -41.27 94.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.091 -0.958 . . . . 1.15 111.652 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.407 ' OD2' HD13 ' A' ' 77' ' ' LEU . 38.7 t70 -71.55 -31.47 67.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.059 0.457 . . . . 0.55 109.853 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -61.86 -29.09 69.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.865 -0.607 . . . . 0.49 110.148 173.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.73 -22.15 79.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.98 -0.629 . . . . 0.27 112.737 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -81.87 -35.39 29.35 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.716 0.769 . . . . 2.95 109.867 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 6.5 mm100 -89.86 -36.88 14.82 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.521 -1.218 . . . . 1.83 110.794 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.638 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 48.7 m-85 -130.21 79.27 73.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.022 0.439 . . . . 0.91 110.408 175.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.98 -37.75 32.05 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 123.146 2.564 . . . . 1.06 113.141 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.5 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 41.6 t80 -69.3 -38.05 78.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.814 0.34 . . . . 2.9 110.592 -175.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.3 mt -75.58 -44.02 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.67 110.956 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.51 76.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.988 0.423 . . . . 1.04 109.961 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.5 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 16.9 tppt? -48.1 -69.51 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.212 -0.903 . . . . 3.06 111.532 171.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.8 m -63.57 -27.45 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 115.372 -0.831 . . . . 0.5 112.569 -174.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.616 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 22.7 m-30 -74.79 -54.12 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.065 -0.654 . . . . 0.92 110.263 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.79 -32.45 73.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 2.58 111.941 -176.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.2 t -75.24 -7.9 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.511 -0.313 . . . . 1.81 110.859 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.7 13.17 83.81 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.867 -0.683 . . . . 1.41 111.774 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.37 -56.09 9.73 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.972 0.415 . . . . 2.46 110.525 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.82 70.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.952 -0.567 . . . . 1.07 110.073 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.437 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -61.25 -36.82 81.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.46 -0.791 . . . . 1.12 111.137 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . 0.433 ' HZ2' ' HB2' ' A' ' 150' ' ' LYS . 0.8 OUTLIER -75.06 -32.76 61.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 3.27 110.169 -179.879 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -68.51 -31.33 70.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.92 -0.582 . . . . 0.68 109.901 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.6 -15.85 62.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.961 -0.563 . . . . 1.18 110.851 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.779 0 CA-C-N 115.839 -0.619 . . . . 1.62 113.101 176.399 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.666 ' HE1' ' CE2' ' A' ' 1' ' ' PHE . 13.6 p90 . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.029 -0.73 . . . . 2.09 109.029 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 4.2 mmmp? -129.32 171.72 12.21 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.667 0.27 . . . . 3.54 110.906 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.619 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 87.1 t80 -56.97 -41.32 78.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.508 0.67 . . . . 2.56 109.89 175.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.471 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 2.1 mp0 -64.35 -24.5 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.809 -1.087 . . . . 4.16 111.999 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -82.91 -14.67 53.75 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.561 -0.456 . . . . 2.57 110.649 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.6 mt -82.18 128.9 66.03 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.222 -0.658 . . . . 1.31 109.222 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -42.49 115.18 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.573 2.849 . . . . 0.7 112.763 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -21.67 66.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 1.23 112.112 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.35 -37.07 82.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.792 0.806 . . . . 1.37 109.685 178.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.661 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 43.4 t80 -80.91 -28.76 35.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.396 -1.274 . . . . 1.08 111.127 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.462 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 14.8 mtm180 -69.46 -21.28 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.723 -0.473 . . . . 2.1 109.723 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.449 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 13.3 t70 -65.68 -21.14 66.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.313 -0.858 . . . . 1.02 110.52 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.2 mt -89.41 -12.43 40.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.947 -0.57 . . . . 1.49 110.937 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 68.1 mtm -95.35 129.2 35.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.029 0.442 . . . . 1.65 110.531 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.464 ' HB2' ' OE1' ' A' ' 17' ' ' GLU . 38.3 Cg_endo -66.67 153.02 79.46 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.858 2.372 . . . . 1.12 112.53 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -42.97 -47.14 8.51 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.384 2.723 . . . . 1.3 113.882 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.486 ' O ' HD12 ' A' ' 66' ' ' LEU . 1.6 pm0 -60.81 -45.3 94.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.661 0.267 . . . . 2.26 111.609 -178.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -28.46 69.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 1.39 110.856 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.778 ' HD2' ' HH ' ' A' ' 3' ' ' TYR . 45.3 mtm105 -89.11 -29.03 19.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.924 -0.58 . . . . 2.54 111.132 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 28.4 t70 -56.02 -38.84 71.07 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.419 0.628 . . . . 1.06 111.134 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.633 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 66.2 t80 -57.71 -58.78 6.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.55 -0.75 . . . . 0.73 110.985 174.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.437 HD22 ' CE1' ' A' ' 100' ' ' TYR . 71.0 mt -75.04 -7.82 54.78 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 119.456 1.026 . . . . 1.75 111.941 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 6.3 tp60 -67.57 -41.63 83.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.247 0.546 . . . . 2.56 110.187 162.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -73.8 -52.46 13.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.585 -0.734 . . . . 1.84 110.838 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.641 HD21 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -50.61 121.36 5.69 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.632 1.206 . . . . 1.7 112.737 -177.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.702 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 15.6 m -141.17 -169.43 2.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 112.547 -2.115 . . . . 2.16 107.938 178.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -57.13 144.05 36.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 118.28 0.491 . . . . 2.39 111.026 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.9 -58.18 0.63 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.799 -0.715 . . . . 1.47 112.248 -178.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.498 ' HB3' ' CD1' ' A' ' 59' ' ' LEU . 40.9 m-20 -87.12 -30.95 20.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.571 0.224 . . . . 2.25 111.29 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.702 ' HG3' ' O ' ' A' ' 26' ' ' SER . 3.0 mtpm? -69.75 -17.97 63.48 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.659 -0.651 . . . . 1.89 110.072 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 9.9 m -64.75 -36.24 83.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.894 -1.048 . . . . 1.37 110.823 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.658 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 12.2 p -81.99 -32.02 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 116.183 -0.462 . . . . 0.85 112.147 -174.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -55.08 -42.74 73.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.348 . . . . 1.65 110.062 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 34' ' ' LYS . 3.7 ttpm? -63.29 -29.01 70.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.427 0.632 . . . . 2.89 110.341 -178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 31' ' ' THR . 9.8 mm-40 -79.26 -45.33 19.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.232 -0.895 . . . . 1.96 110.769 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.0 m -75.79 -37.0 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 112.276 0.473 . . . . 0.98 112.276 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.604 ' HD1' ' CD2' ' A' ' 37' ' ' PHE . 15.0 m-85 -62.12 -43.97 97.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.812 1.042 . . . . 1.08 113.812 171.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -80.51 -17.48 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.694 -0.803 . . . . 2.71 110.57 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.58 -77.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 1.57 109.904 168.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.78 -147.16 2.37 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 121.058 -0.591 . . . . 1.54 112.558 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -91.22 123.14 4.82 Favored 'Cis proline' 0 N--CA 1.457 -0.654 0 CA-C-N 118.747 1.274 . . . . 1.99 110.541 -12.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.55 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 21.4 m-85 -99.04 116.95 32.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.55 0.69 . . . . 1.72 111.873 -169.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -71.02 -15.88 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.708 -1.133 . . . . 4.11 111.422 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.432 ' OD1' ' HB2' ' A' ' 46' ' ' GLU . 9.1 p30 -147.2 164.45 33.12 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.156 -0.313 . . . . 1.53 110.156 -174.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.466 HG22 ' CD2' ' A' ' 67' ' ' HIS . 9.2 m -73.18 -32.22 64.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 1.72 111.918 -176.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.432 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 50.1 mt-10 -58.36 -41.81 85.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.565 0.222 . . . . 2.24 111.051 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.55 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.3 OUTLIER -61.98 -33.51 74.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.588 -0.278 . . . . 2.26 111.529 176.629 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.4 m -71.69 -40.29 69.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.27 0.557 . . . . 1.69 109.821 177.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.84 -44.86 98.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.34 -0.845 . . . . 1.2 110.266 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -55.9 -49.24 73.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.368 -0.833 . . . . 1.29 111.255 175.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.33 -41.6 65.89 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.987 -0.551 . . . . 1.21 111.017 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -70.54 -40.82 73.19 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.801 -0.636 . . . . 1.13 111.199 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.482 ' HZ2' ' HG3' ' A' ' 64' ' ' GLU . 91.3 mttt -62.89 -33.64 75.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.08 0.4 . . . . 1.87 112.08 -178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 33.4 mmtp -71.91 -28.44 63.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.393 -0.367 . . . . 3.57 111.463 -177.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.658 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -99.02 -50.53 4.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.08 0.466 . . . . 2.01 110.818 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 t -127.42 93.67 40.2 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.697 -0.853 . . . . 1.68 108.697 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.93 -53.31 7.28 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.798 2.998 . . . . 0.84 112.63 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 17.1 tp10 -57.34 -37.68 72.94 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 114.481 -1.236 . . . . 2.45 111.655 177.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.498 ' CD1' ' HB3' ' A' ' 29' ' ' ASP . 1.6 tt -70.04 -45.78 66.42 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.246 -1.02 . . . . 2.03 108.246 -174.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.43 84.14 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 114.235 -1.348 . . . . 0.41 111.865 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.78 81.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.809 0.338 . . . . 1.19 110.528 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 96.2 mttt -62.72 -53.02 60.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.087 -0.506 . . . . 2.7 110.836 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -67.61 -28.71 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.489 -0.323 . . . . 1.12 111.203 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.482 ' HG3' ' HZ2' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -62.04 -60.02 4.22 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 110.096 -0.335 . . . . 1.7 110.096 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.639 ' O ' ' HG3' ' A' ' 69' ' ' MET . 70.8 mmtt -64.14 -36.64 84.69 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.298 0.57 . . . . 4.35 109.827 -176.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.486 HD12 ' O ' ' A' ' 17' ' ' GLU . 15.1 tp -63.24 -38.79 92.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.94 -1.027 . . . . 2.09 110.648 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.466 ' CD2' HG22 ' A' ' 45' ' ' THR . 48.6 t-80 -81.62 -33.34 31.53 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.746 -0.661 . . . . 3.07 109.62 -175.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.69 -36.56 83.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.222 -0.899 . . . . 1.26 111.185 177.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.639 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 26.6 mtm -63.38 -54.15 41.31 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.203 0.525 . . . . 1.21 109.918 176.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.2 t -54.74 -40.77 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.296 -0.866 . . . . 0.79 110.108 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.66 -40.73 92.76 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.77 -1.105 . . . . 2.03 111.207 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.3 m -57.57 -37.69 73.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 1.66 110.721 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.8 mttm -67.45 -46.69 72.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 2.14 110.31 176.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.88 -29.29 42.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.005 0.431 . . . . 1.1 111.698 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.33 -37.47 85.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.487 0.66 . . . . 1.18 109.956 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.61 -1.47 56.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.789 -1.096 . . . . 1.11 111.152 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.433 HD12 ' HA ' ' A' ' 132' ' ' PHE . 8.9 tp -92.85 134.99 34.54 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.169 -0.469 . . . . 1.34 109.857 -176.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.63 149.83 51.58 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.599 -0.81 . . . . 0.76 111.846 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -39.05 -36.33 0.7 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 124.381 3.387 . . . . 1.89 114.452 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.88 -56.03 18.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.335 0.588 . . . . 2.52 109.68 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.94 -29.99 35.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.664 -0.698 . . . . 1.13 110.807 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -61.74 -38.85 89.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.578 -0.737 . . . . 2.52 110.86 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.57 -40.24 95.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.584 -0.817 . . . . 0.46 111.443 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.421 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 32.7 t80 -67.79 -49.88 59.96 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.837 -0.181 . . . . 2.04 111.223 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.97 -51.89 59.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.945 0.403 . . . . 1.07 112.004 -176.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -71.06 -27.7 63.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.335 -0.393 . . . . 1.96 111.359 -175.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.487 ' O ' ' HB3' ' A' ' 90' ' ' GLU . 58.7 tttp -84.08 -39.48 19.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.552 0.215 . . . . 2.74 111.049 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 p -65.24 -46.09 82.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.795 0.331 . . . . 0.65 110.228 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.84 -31.59 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.017 -0.538 . . . . 1.79 110.339 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 9.3 tp10 -61.91 -47.56 84.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.884 0.374 . . . . 2.82 110.269 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.09 -46.86 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 1.2 110.398 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.407 ' O ' ' HD2' ' A' ' 96' ' ' LYS . . . -64.33 -35.97 82.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.827 -0.624 . . . . 1.23 110.829 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.424 ' HA ' ' CD ' ' A' ' 96' ' ' LYS . 46.1 mtm180 -62.18 -41.46 98.35 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.795 -0.639 . . . . 5.02 110.813 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -60.82 -33.94 85.08 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.768 -0.729 . . . . 0.72 112.013 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.5 mm -64.0 -43.42 97.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.598 0.237 . . . . 1.23 111.508 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.553 ' HB3' ' HZ3' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -93.48 -9.47 38.31 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 119.916 -0.714 . . . . 3.16 110.753 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.21 78.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.056 0.455 . . . . 1.33 109.891 170.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 12.1 ptm180 -85.23 3.43 39.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 3.64 110.043 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.471 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.2 m-85 -90.42 -45.51 8.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.037 -0.727 . . . . 1.28 109.037 162.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.615 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 35.2 m-85 -59.63 -34.25 72.55 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 1.78 111.785 -177.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.5 p -71.73 -2.66 18.26 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.404 0.52 . . . . 1.51 112.404 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 92.58 31.64 8.68 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.807 -0.711 . . . . 1.16 112.304 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 44.7 m-80 -130.8 176.23 8.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.53 -0.545 . . . . 2.22 109.53 -178.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 49.8 mt-10 -142.73 106.87 5.43 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 111.654 0.242 . . . . 1.75 111.654 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.4 Cg_endo -59.17 160.29 19.58 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.834 2.356 . . . . 0.71 111.886 173.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 72.2 p -86.1 165.15 16.83 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.127 -0.694 . . . . 2.17 109.127 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 8.7 ptpp? -61.97 -23.72 66.56 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.334 -0.546 . . . . 3.31 109.88 177.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.409 ' HA ' ' HD2' ' A' ' 111' ' ' LYS . 16.4 m-20 -72.27 -32.43 66.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.693 -0.685 . . . . 2.24 110.937 178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -62.98 -41.29 99.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.421 0.629 . . . . 1.73 109.694 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.5 mp -66.19 -41.07 90.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.229 -0.896 . . . . 1.56 110.413 177.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 93.5 mttt -54.49 -52.72 61.04 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.959 0.409 . . . . 2.31 109.939 174.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -59.84 -43.34 94.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.611 -0.722 . . . . 1.19 111.143 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.2 t -55.93 -48.84 74.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 1.84 111.667 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 5.0 m -80.95 -24.85 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.616 0.722 . . . . 0.66 110.056 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -66.63 -41.5 88.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 2.26 111.333 179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -71.87 -35.46 69.81 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.57 -0.452 . . . . 2.27 110.706 -178.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 m -65.37 -33.16 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.678 -0.409 . . . . 0.91 110.251 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.557 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 85.1 mt -72.78 -34.85 67.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.038 -0.356 . . . . 1.75 110.038 176.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.01 -43.8 95.0 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.148 -0.686 . . . . 1.51 109.148 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -69.83 -48.07 60.36 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.123 -0.944 . . . . 1.68 111.498 174.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 121' ' ' TYR . 37.9 t80 -69.61 -37.92 77.07 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.878 -0.729 . . . . 2.2 111.702 -168.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -61.07 -33.02 72.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.828 0.347 . . . . 2.44 111.097 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -87.36 -8.03 57.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.746 0.647 . . . . 1.16 112.746 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -74.3 159.71 32.06 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.275 -0.57 . . . . 1.15 111.558 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -59.26 145.06 44.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.067 -0.515 . . . . 1.57 110.494 173.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.91 -43.39 98.92 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.275 -0.42 . . . . 2.21 111.999 -174.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.4 -29.74 70.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 1.18 110.656 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.99 -36.27 57.29 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.563 -0.744 . . . . 0.35 111.602 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.603 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 98.9 mttt -63.6 -45.98 87.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.336 0.588 . . . . 1.84 110.061 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.32 74.56 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.443 -0.799 . . . . 1.15 111.431 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -74.21 -31.95 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.601 -0.518 . . . . 0.55 109.601 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.433 ' HA ' HD12 ' A' ' 77' ' ' LEU . 90.9 t80 -60.11 -34.22 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.699 -0.682 . . . . 0.49 109.811 172.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.15 -10.42 78.2 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.27 113.202 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -87.72 -29.34 21.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.351 0.596 . . . . 2.95 110.268 177.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.498 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -100.98 -37.81 8.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.192 -0.913 . . . . 1.83 111.046 -176.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.665 ' HD2' ' CD1' ' A' ' 136' ' ' PHE . 57.9 m-85 -128.05 71.47 78.94 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.907 0.384 . . . . 0.91 110.073 175.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -62.44 -36.66 64.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.045 2.496 . . . . 1.06 112.427 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 1.67 ' HD1' ' CD2' ' A' ' 138' ' ' PHE . 61.7 t80 -64.31 -41.62 96.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.46 -0.336 . . . . 2.9 110.344 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.02 -44.68 63.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.486 -0.325 . . . . 1.67 110.333 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -57.19 -40.71 77.92 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.95 -0.389 . . . . 1.04 109.95 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 22.6 ttpp -46.25 -71.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.323 -0.853 . . . . 3.06 111.193 172.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.435 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.1 m -62.83 -26.51 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.658 -0.701 . . . . 0.5 112.259 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -74.51 -41.64 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.848 -0.741 . . . . 0.92 110.488 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 37.3 mt-10 -79.68 -31.71 41.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.747 0.308 . . . . 2.58 111.073 -178.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 57.3 m -70.18 -10.76 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 1.81 111.224 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 79.41 14.99 80.78 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.853 -0.689 . . . . 1.41 111.547 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.449 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 54.8 tptt -69.49 -59.9 2.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.805 0.336 . . . . 2.46 110.585 -177.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.28 75.46 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.132 0.491 . . . . 1.07 109.781 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.557 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -59.32 -45.61 90.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.342 -0.845 . . . . 1.12 111.136 178.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -67.47 -39.81 85.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.317 -0.401 . . . . 3.27 110.405 -178.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.66 ' HD1' ' CD2' ' A' ' 151' ' ' PHE . 47.8 t80 -59.81 -39.53 85.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.917 -0.583 . . . . 0.68 110.537 176.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -73.2 -21.13 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.49 . . . . 1.18 111.515 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.784 0 N-CA-C 110.447 -1.061 . . . . 1.62 110.447 -171.746 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 1.618 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 11.2 p90 . . . . . 0 C--O 1.239 0.506 0 CA-C-O 121.103 0.478 . . . . 2.09 110.116 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.586 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 10.5 mtmp? -121.62 155.65 34.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.964 -0.562 . . . . 3.54 109.676 177.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.618 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 47.6 m-85 -83.79 -0.16 49.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.07 0.938 . . . . 2.56 109.592 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -84.16 -19.79 33.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.94 -1.482 . . . . 4.16 108.881 170.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.586 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 9.8 m-20 -96.76 -14.58 21.87 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.88 -0.6 . . . . 2.57 110.344 -174.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.08 130.69 71.74 Favored Pre-proline 0 N--CA 1.449 -0.491 0 N-CA-C 108.601 -0.889 . . . . 1.31 108.601 176.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -40.5 106.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.342 2.694 . . . . 0.7 112.533 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.79 -22.3 66.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.574 -0.739 . . . . 1.23 111.474 -174.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -63.91 -29.26 70.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.918 0.866 . . . . 1.37 109.559 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.612 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 40.4 t80 -91.8 -27.92 17.69 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.178 -1.374 . . . . 1.08 110.723 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HD2' ' SD ' ' A' ' 14' ' ' MET . 7.3 mmm180 -68.13 -23.8 64.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.336 0.589 . . . . 2.1 109.544 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.6 -30.12 71.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.989 -1.005 . . . . 1.02 110.587 173.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.6 mt -82.34 -14.94 54.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.961 -0.563 . . . . 1.49 110.246 -177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.401 ' SD ' ' HD2' ' A' ' 11' ' ' ARG . 66.9 mtt -71.16 130.19 88.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 1.65 110.616 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.48 126.62 18.02 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.267 1.978 . . . . 1.12 111.683 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -40.33 -48.78 4.06 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.963 3.109 . . . . 1.3 114.571 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -75.99 -24.17 55.32 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.814 0.301 . . . . 2.26 111.814 -175.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.34 54.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.265 -0.643 . . . . 1.39 109.265 174.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -71.61 -29.71 64.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.221 -0.899 . . . . 2.54 110.242 173.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -49.49 -53.72 21.67 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.849 0.718 . . . . 1.06 110.798 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.625 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 87.6 t80 -52.88 -62.11 1.86 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.054 -0.521 . . . . 0.73 111.723 178.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.725 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 36.5 mt -69.25 -20.14 63.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 118.856 0.753 . . . . 1.75 111.821 -177.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -64.7 -31.81 73.19 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 119.187 0.903 . . . . 2.56 110.91 166.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.536 ' HB2' ' O ' ' A' ' 21' ' ' PHE . 0.9 OUTLIER -68.11 -47.65 67.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.073 -0.512 . . . . 1.84 112.178 179.505 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' HH ' ' A' ' 3' ' ' TYR . 3.2 mm? -59.53 140.54 56.19 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.32 0.581 . . . . 1.7 111.177 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 t -122.53 -68.56 0.88 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.221 -0.9 . . . . 2.16 111.463 -174.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -151.13 -70.51 0.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.016 0.376 . . . . 2.39 112.016 -174.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.36 -27.3 72.96 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.105 -0.569 . . . . 1.47 112.687 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -73.84 -35.66 64.82 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.892 0.377 . . . . 2.25 110.843 178.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.95 -30.06 71.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.006 0.432 . . . . 1.89 110.929 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 44.3 m -56.28 -43.86 79.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.656 -0.702 . . . . 1.37 111.223 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.572 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.0 p -79.12 -28.55 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.957 -0.565 . . . . 0.85 110.39 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.44 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.0 mm? -55.79 -46.72 77.9 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 121.119 0.485 . . . . 1.65 109.799 168.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HG2' ' HE3' ' A' ' 38' ' ' LYS . 37.2 ttmt -57.06 -29.92 63.83 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.326 -0.852 . . . . 2.89 110.665 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -78.92 -34.18 44.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 1.96 111.232 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 78.4 t -71.29 -49.51 47.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.246 0.546 . . . . 0.98 110.478 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.468 ' HE2' ' CD2' ' A' ' 100' ' ' TYR . 35.4 m-85 -57.43 -24.63 56.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.174 0.805 . . . . 1.08 113.174 176.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.442 ' HE3' ' HG2' ' A' ' 34' ' ' LYS . 9.7 mtmp? -101.42 14.68 31.22 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.966 -0.694 . . . . 2.71 110.911 176.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.86 23.33 10.75 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.086 -0.506 . . . . 1.57 110.747 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.64 -149.86 9.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.88 -0.676 . . . . 1.54 111.852 174.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.0 162.94 86.45 Favored 'Cis proline' 0 N--CA 1.462 -0.346 0 CA-C-N 118.827 1.313 . . . . 1.99 112.064 -2.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -119.01 134.06 55.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.955 -0.566 . . . . 1.72 110.217 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -91.39 -6.29 53.13 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.099 -0.955 . . . . 4.11 109.981 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.424 HD22 ' HG3' ' A' ' 47' ' ' GLU . 5.7 p30 -156.15 149.99 25.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.619 -0.719 . . . . 1.53 109.607 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.2 m -61.6 -26.59 68.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.518 -0.765 . . . . 1.72 111.45 -177.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.99 -33.2 75.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 2.24 111.833 -177.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.424 ' HG3' HD22 ' A' ' 44' ' ' ASN . 44.5 mt-10 -63.11 -35.33 79.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 2.26 110.867 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.8 t -69.68 -35.77 75.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.646 -0.501 . . . . 1.69 109.646 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 77.5 mt -66.58 -43.36 90.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.737 -0.665 . . . . 1.2 110.108 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 -50.79 72.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.305 -0.861 . . . . 1.29 111.148 176.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.77 82.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 1.21 110.773 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.8 mt -68.59 -37.56 79.92 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.646 -0.706 . . . . 1.13 111.376 179.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -61.56 -38.96 89.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.003 0.43 . . . . 1.87 110.825 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -69.54 -50.75 41.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 3.57 110.811 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.572 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 12.5 mmtt -66.91 -43.81 82.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.8 -0.636 . . . . 2.01 112.32 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.2 m -149.86 97.17 3.47 Favored Pre-proline 0 C--N 1.315 -0.893 0 O-C-N 122.073 -0.392 . . . . 1.68 110.485 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -40.82 -56.13 1.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.86 3.04 . . . . 0.84 113.276 -171.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.57 -34.54 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.596 -1.184 . . . . 2.45 112.208 -177.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 mt -71.71 -40.54 69.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.698 0.761 . . . . 2.03 109.156 -176.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.62 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.54 -35.08 91.27 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.35 -1.296 . . . . 0.41 111.526 175.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.439 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -69.24 -42.31 75.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.64 0.257 . . . . 1.19 110.34 174.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -55.37 -53.28 58.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.967 -0.561 . . . . 2.7 110.981 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.1 -30.93 45.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 1.12 111.15 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.62 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -62.24 -58.28 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.404 -0.362 . . . . 1.7 110.224 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 69' ' ' MET . 85.7 mttt -61.56 -38.79 88.8 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.388 0.614 . . . . 4.35 110.03 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -39.47 93.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.062 -0.972 . . . . 2.09 109.82 -179.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.53 -29.24 46.34 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.77 -0.65 . . . . 3.07 109.292 -175.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.19 -39.82 95.74 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.086 -0.961 . . . . 1.26 111.321 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.574 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 20.2 mtm -64.93 -46.94 79.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.429 -0.582 . . . . 1.21 109.429 177.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.1 t -56.71 -42.61 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 114.912 -1.04 . . . . 0.79 110.289 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -64.17 -38.87 92.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.798 -0.637 . . . . 2.03 110.811 177.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -56.89 -33.3 66.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.196 0.522 . . . . 1.66 110.382 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 69' ' ' MET . 65.4 mmtt -79.38 -49.63 12.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.6 -0.727 . . . . 2.14 110.441 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -69.37 -25.89 30.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.126 0.488 . . . . 1.1 111.514 -176.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -36.11 76.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.712 0.767 . . . . 1.18 109.698 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.47 2.82 52.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.527 -1.215 . . . . 1.11 110.536 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 132' ' ' PHE . 10.9 tp -93.33 134.23 35.75 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.567 -0.742 . . . . 1.34 109.321 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.39 153.57 46.07 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.762 -0.732 . . . . 0.76 111.838 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -43.07 -38.62 7.49 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.85 3.034 . . . . 1.89 113.657 -178.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.06 -54.3 40.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 2.52 110.315 -177.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -80.84 -28.09 36.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.817 -0.628 . . . . 1.13 110.936 -174.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 41.4 ttmt -55.32 -44.37 75.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.626 -0.715 . . . . 2.52 110.278 176.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.409 ' O ' ' HD3' ' A' ' 87' ' ' LYS . . . -59.98 -42.14 98.19 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.943 -0.646 . . . . 0.46 112.02 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -67.2 -43.87 81.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.742 0.306 . . . . 2.04 110.985 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -45.38 93.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.372 -0.376 . . . . 1.07 111.456 -177.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 33.5 mt-10 -66.42 -23.25 66.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.274 -0.421 . . . . 1.96 111.045 -177.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.409 ' HD3' ' O ' ' A' ' 83' ' ' GLY . 5.7 mptp? -87.68 -48.48 7.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.365 -0.38 . . . . 2.74 111.258 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 10.8 p -61.47 -39.55 91.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.637 0.256 . . . . 0.65 111.069 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -59.98 -45.04 95.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 1.79 110.866 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.2 -36.4 69.19 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.576 0.227 . . . . 2.82 111.323 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 95.0 mt -61.28 -52.2 64.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 1.2 110.362 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.16 77.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 1.23 110.801 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -60.61 -42.5 96.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.036 -0.529 . . . . 5.02 110.89 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.17 -32.58 84.64 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.008 -0.615 . . . . 0.72 111.982 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.8 mm -61.4 -49.27 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.001 0.429 . . . . 1.23 110.55 179.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.4 mppt? -94.93 21.46 7.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.148 0.499 . . . . 3.16 110.576 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -105.23 -34.91 7.74 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.533 -0.758 . . . . 1.33 109.047 168.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.506 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 6.4 ptp180 -80.75 -15.85 55.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.946 -0.57 . . . . 3.64 109.61 175.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.401 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.7 m-85 -65.26 -35.78 82.1 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.135 -0.691 . . . . 1.28 109.135 166.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.645 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 13.4 m-85 -75.27 -46.36 34.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.582 -0.735 . . . . 1.78 112.019 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 41.6 p -60.23 -21.82 62.28 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.865 0.691 . . . . 1.51 112.865 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.16 29.41 5.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.844 -0.693 . . . . 1.16 111.957 -174.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -132.77 68.86 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.305 -0.628 . . . . 2.22 109.305 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.63 110.68 2.54 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.898 -0.592 . . . . 1.75 111.745 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.426 ' HG3' ' HG3' ' A' ' 98' ' ' ARG . 78.2 Cg_exo -50.78 148.75 15.53 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.8 3.0 . . . . 0.71 113.772 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -88.61 168.76 12.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.788 -0.819 . . . . 2.17 108.788 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.537 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.7 tppt? -59.93 -38.39 82.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.403 0.547 . . . . 3.31 109.783 -176.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.03 -31.16 72.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.972 -1.013 . . . . 2.24 111.258 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -64.15 -44.41 92.2 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.239 0.542 . . . . 1.73 109.837 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.8 mp -68.0 -44.73 75.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 1.56 110.789 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 58.4 mtpt -54.66 -46.55 74.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.392 0.615 . . . . 2.31 110.133 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.74 -43.17 94.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 1.19 111.723 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -64.43 -39.17 93.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.977 0.362 . . . . 1.84 111.977 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.3 m -76.74 -27.96 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-O 121.671 0.748 . . . . 0.66 109.292 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -62.13 -37.65 85.96 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.9 . . . . 2.26 111.036 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.428 ' O ' HD11 ' A' ' 120' ' ' LEU . 8.7 tt0 -77.35 -34.55 55.11 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 116.453 -0.34 . . . . 2.27 111.147 -175.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 m -62.02 -34.59 64.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.562 -0.455 . . . . 0.91 109.91 171.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.0 mt -72.81 -34.13 66.68 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.281 -0.266 . . . . 1.75 110.281 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -59.85 -42.45 93.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.439 0.638 . . . . 1.51 109.344 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.428 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.5 mp -73.58 -45.12 55.16 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.192 -0.913 . . . . 1.68 111.288 175.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.646 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 34.6 t80 -72.56 -30.75 64.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.99 -0.684 . . . . 2.2 111.893 -170.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.12 -35.79 81.43 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.006 0.432 . . . . 2.44 110.924 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.98 -4.68 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.896 0.702 . . . . 1.16 112.896 -173.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.403 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 55.3 mtm -75.0 154.41 38.07 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.425 -0.51 . . . . 1.15 110.902 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.8 m -64.02 140.63 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.269 -0.423 . . . . 1.57 110.446 176.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -52.64 -45.75 66.81 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.44 0.533 . . . . 2.21 112.44 -170.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -32.47 70.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 1.18 111.108 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.88 -34.2 53.5 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.484 -0.646 . . . . 0.35 111.484 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -67.37 -44.99 77.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.226 0.536 . . . . 1.84 110.371 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.19 -41.66 89.04 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.144 -0.935 . . . . 1.15 111.363 178.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -71.6 -26.65 62.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.05 -0.977 . . . . 0.55 110.407 -174.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . 0.428 ' HA ' HD12 ' A' ' 77' ' ' LEU . 92.2 t80 -63.01 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.753 -0.658 . . . . 0.49 109.898 172.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -74.84 -5.45 74.85 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 121.045 -0.597 . . . . 0.27 112.92 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -94.41 -37.38 11.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.398 0.618 . . . . 2.95 109.874 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.481 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 75.1 mm-40 -90.79 -33.84 15.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.004 -0.998 . . . . 1.83 110.922 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.663 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 43.4 m-85 -133.38 72.57 74.85 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 0.91 110.471 174.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.93 -29.52 67.08 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.984 2.456 . . . . 1.06 111.774 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -64.58 -39.3 93.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.465 -0.789 . . . . 2.9 111.029 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.6 mt -81.93 -40.18 22.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.522 -0.308 . . . . 1.67 110.605 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.66 70.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.115 0.483 . . . . 1.04 110.127 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.01 -69.59 0.11 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.373 -0.83 . . . . 3.06 111.088 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 148' ' ' ALA . 0.4 OUTLIER -60.19 -30.71 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.071 -0.968 . . . . 0.5 112.631 -174.504 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -73.65 -47.08 42.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.149 -0.621 . . . . 0.92 110.726 -175.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -74.51 -30.86 61.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.558 -0.292 . . . . 2.58 111.639 -175.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 12.4 p -73.04 -16.35 61.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.09 0.471 . . . . 1.81 110.636 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 93.49 1.45 66.29 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.697 -0.763 . . . . 1.41 112.696 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.39 -45.67 93.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.616 0.246 . . . . 2.46 110.93 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . 0.441 ' HB3' ' CG2' ' A' ' 142' ' ' VAL . . . -66.17 -39.51 89.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.855 0.359 . . . . 1.07 110.132 176.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.66 82.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 1.12 111.485 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -75.19 -35.7 61.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 3.27 111.117 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 45.6 t80 -67.39 -35.43 79.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.099 0.476 . . . . 0.68 109.889 174.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -72.15 -33.8 68.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.586 -0.733 . . . . 1.18 111.216 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.494 0 CA-C-N 115.619 -0.719 . . . . 1.62 112.758 179.557 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . 0.613 ' CD2' ' HD3' ' A' ' 30' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.268 0.556 . . . . 2.09 110.895 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . 33.8 mmtp -116.61 146.3 42.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.734 -0.666 . . . . 3.54 109.834 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.645 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 85.9 t80 -74.47 -31.36 62.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 2.56 109.941 -179.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -75.99 -5.51 46.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.687 -0.688 . . . . 4.16 110.439 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 2' ' ' LYS . 20.9 t70 -95.46 -16.51 22.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.002 -0.545 . . . . 2.57 109.904 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.47 ' HB ' ' HD2' ' A' ' 11' ' ' ARG . 65.1 mt -70.31 137.72 86.6 Favored Pre-proline 0 C--O 1.236 0.353 0 N-CA-C 108.961 -0.755 . . . . 1.31 108.961 175.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -42.24 116.2 0.58 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.463 . . . . 0.7 112.111 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.94 -16.75 64.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 1.23 112.045 -173.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.14 -30.39 60.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.835 0.826 . . . . 1.37 109.68 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.635 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 72.7 t80 -82.95 -29.37 29.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.55 -1.205 . . . . 1.08 110.849 -178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.47 ' HD2' ' HB ' ' A' ' 6' ' ' ILE . 45.5 mtp180 -70.8 -17.42 62.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.49 0.662 . . . . 2.1 109.952 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -72.14 -22.88 61.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.872 -1.058 . . . . 1.02 110.612 176.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.35 -12.28 40.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.191 -0.459 . . . . 1.49 111.182 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 66.1 mtt -75.82 124.64 88.7 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.428 -0.351 . . . . 1.65 110.801 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . 0.412 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 54.0 Cg_endo -71.99 153.36 57.86 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.566 2.177 . . . . 1.12 111.558 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -45.49 -53.88 5.04 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.593 2.862 . . . . 1.3 113.59 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.551 ' O ' HD22 ' A' ' 66' ' ' LEU . 44.0 mt-10 -59.87 -38.12 81.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.749 0.309 . . . . 2.26 111.585 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.47 58.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.726 0.298 . . . . 1.39 111.1 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 23.0 mtm180 -73.83 -45.03 53.78 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.161 -0.472 . . . . 2.54 110.409 177.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -47.65 -44.87 27.39 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.112 0.883 . . . . 1.06 111.473 -172.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.657 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 38.5 t80 -59.94 -67.27 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.022 -0.535 . . . . 0.73 111.632 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.906 HD22 ' HH ' ' A' ' 100' ' ' TYR . 24.1 mt -70.61 -11.04 60.68 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.74 1.155 . . . . 1.75 112.493 -177.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.65 -40.79 88.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.257 0.551 . . . . 2.56 109.769 163.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -74.7 -48.25 26.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.346 -0.843 . . . . 1.84 112.041 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.76 140.64 54.66 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.537 0.684 . . . . 1.7 111.852 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.2 p -139.94 -169.47 2.74 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.653 -1.158 . . . . 2.16 109.531 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.17 150.71 33.46 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.765 -0.457 . . . . 2.39 109.765 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.51 -53.8 4.38 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.501 -0.857 . . . . 1.47 111.322 -174.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.57 -44.78 81.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.523 0.677 . . . . 2.25 109.525 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.613 ' HD3' ' CD2' ' A' ' 1' ' ' PHE . 89.9 mttt -72.07 -12.58 61.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.321 -0.854 . . . . 1.89 110.664 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -76.46 -43.43 39.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.892 -0.594 . . . . 1.37 109.711 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.0 p -79.36 -29.93 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 115.431 -0.804 . . . . 0.85 110.498 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.534 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 23.4 mt -56.18 -42.74 77.58 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.869 0.366 . . . . 1.65 110.768 171.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 39.6 ttmt -54.56 -42.1 70.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.903 -0.59 . . . . 2.89 110.929 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.942 -0.572 . . . . 1.96 111.548 -176.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.86 -52.26 11.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.513 0.673 . . . . 0.98 109.564 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.669 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 47.5 m-85 -58.32 -50.47 73.52 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 115.223 1.564 . . . . 1.08 115.223 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 15.5 ptpt -86.54 18.04 3.53 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.42 -0.912 . . . . 2.71 111.729 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.46 -78.67 0.59 Allowed 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.509 -0.768 . . . . 1.57 109.388 169.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 44.77 -151.37 0.75 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 121.084 -0.579 . . . . 1.54 113.22 -175.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 9.3 Cg_endo -89.28 147.0 22.42 Favored 'Cis proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.986 -1.256 . . . . 1.99 111.318 -6.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.411 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 36.0 m-85 -118.02 114.05 22.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.775 -0.648 . . . . 1.72 110.566 -175.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.452 ' HG3' HD21 ' A' ' 44' ' ' ASN . 13.4 ptmm? -73.19 -7.21 50.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.407 -0.815 . . . . 4.11 111.239 177.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.452 HD21 ' HG3' ' A' ' 43' ' ' LYS . 8.4 p30 -150.03 161.97 41.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.902 -0.407 . . . . 1.53 109.902 -178.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.9 m -73.51 -28.01 61.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.289 -0.414 . . . . 1.72 110.86 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 38.2 mt-10 -59.51 -40.98 88.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 2.24 111.113 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.411 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.9 mt-10 -62.99 -35.17 79.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.738 0.304 . . . . 2.26 111.145 176.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.4 m -69.93 -40.84 75.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.156 0.503 . . . . 1.69 110.006 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 76.2 mt -65.08 -42.72 95.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 1.2 110.212 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.31 80.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.298 -0.864 . . . . 1.29 111.285 176.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.74 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.433 0.635 . . . . 1.21 110.258 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD22 HD21 ' A' ' 33' ' ' LEU . 36.4 mt -69.86 -36.35 75.43 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.202 -0.908 . . . . 1.13 111.395 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -65.12 -30.24 71.16 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.926 -0.31 . . . . 1.87 111.147 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -75.0 -44.37 48.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.206 0.527 . . . . 3.57 110.402 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.454 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 52.3 mmtt -68.71 -55.95 9.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.711 . . . . 2.01 111.607 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 m -142.54 95.7 6.43 Favored Pre-proline 0 C--N 1.315 -0.93 0 N-CA-C 110.214 -0.291 . . . . 1.68 110.214 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.34 -59.61 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.96 3.107 . . . . 0.84 113.95 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -66.88 -22.07 65.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.49 -0.777 . . . . 2.45 112.286 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 3.4 tt -73.85 -41.53 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.602 -1.258 . . . . 2.03 107.602 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.3 -33.11 86.36 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 114.264 -1.334 . . . . 0.41 111.311 174.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.453 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -65.42 -39.86 92.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.796 0.331 . . . . 1.19 110.272 173.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.455 ' HB3' ' O ' ' A' ' 59' ' ' LEU . 16.5 tppt? -57.0 -57.42 12.64 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.638 -0.71 . . . . 2.7 110.916 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.48 -35.65 73.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.327 -0.397 . . . . 1.12 111.246 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.26 -64.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.228 -0.442 . . . . 1.7 111.458 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HD3' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.55 -32.12 73.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.251 0.548 . . . . 4.35 110.788 -173.016 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.556 ' N ' ' HD3' ' A' ' 65' ' ' LYS . 3.4 tm? -67.29 -46.54 73.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.389 -0.823 . . . . 2.09 110.143 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -24.74 57.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.911 -0.774 . . . . 3.07 108.911 -175.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.67 81.94 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.923 -1.035 . . . . 1.26 111.804 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.487 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 34.6 mtm -65.08 -50.73 65.0 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.321 -0.622 . . . . 1.21 109.321 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 89.0 t -53.7 -43.62 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 114.795 -1.093 . . . . 0.79 110.238 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -60.82 -40.17 91.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.311 -0.859 . . . . 2.03 110.683 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.8 m -63.3 -39.31 94.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.641 0.258 . . . . 1.66 111.048 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' A' ' 69' ' ' MET . 32.9 mmtp -66.64 -43.87 83.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 2.14 110.225 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.469 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 77.9 mt -72.51 -23.44 21.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.242 0.544 . . . . 1.1 111.021 178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.14 -30.44 67.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.584 0.707 . . . . 1.18 110.184 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.85 2.91 56.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.863 -1.062 . . . . 1.11 110.761 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.494 HD11 ' CG ' ' A' ' 135' ' ' GLN . 11.5 tp -95.76 132.67 40.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.715 -0.675 . . . . 1.34 110.378 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.86 151.24 49.56 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.894 -0.67 . . . . 0.76 112.061 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -41.07 -42.83 4.84 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 124.075 3.183 . . . . 1.89 114.312 -176.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -60.53 -51.7 68.32 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.417 0.627 . . . . 2.52 110.305 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . 0.524 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.63 -30.74 32.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.146 -0.934 . . . . 1.13 110.646 -173.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.484 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 27.7 ttpp -59.3 -44.59 92.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 2.52 110.518 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.68 -41.68 90.23 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.683 -0.77 . . . . 0.46 111.436 178.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.12 -48.84 66.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.269 . . . . 2.04 111.225 175.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.28 -45.6 76.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.167 0.508 . . . . 1.07 111.388 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.642 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 38.8 mt-10 -67.83 -43.37 79.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 1.96 110.419 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -66.35 -44.04 84.39 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.731 0.301 . . . . 2.74 111.301 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.2 p -62.77 -41.48 99.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.347 -0.388 . . . . 0.65 110.914 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.646 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 28.8 mt -64.59 -39.77 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 116.376 -0.374 . . . . 1.79 110.843 177.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.642 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.3 mt-10 -52.97 -44.26 67.02 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.969 0.414 . . . . 2.82 110.646 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 48.3 mt -69.55 -44.25 79.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.827 -0.624 . . . . 1.2 110.753 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.95 -22.55 64.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 1.23 111.28 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . 0.646 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 39.2 mtm180 -63.41 -50.25 70.59 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.803 -0.443 . . . . 5.02 109.803 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.96 -35.76 92.41 Favored Glycine 0 N--CA 1.453 -0.219 0 CA-C-N 115.961 -0.563 . . . . 0.72 113.185 -172.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.4 -49.44 83.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.991 0.424 . . . . 1.23 110.664 -178.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.482 ' HB2' ' HZ1' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -94.89 7.02 47.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.373 -0.376 . . . . 3.16 111.033 -179.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -86.24 -30.83 22.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.218 -0.66 . . . . 1.33 109.218 167.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 61.1 mtp180 -83.24 -7.72 59.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.749 -0.66 . . . . 3.64 109.404 174.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.47 ' CE1' ' HD2' ' A' ' 105' ' ' PRO . 8.4 m-85 -80.05 -26.13 39.84 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.084 -0.71 . . . . 1.28 109.084 166.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.663 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 23.1 m-85 -80.14 -49.26 11.95 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.131 -0.486 . . . . 1.78 110.723 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.499 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 55.1 p -63.97 -22.33 66.88 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.756 -0.656 . . . . 1.51 112.501 -174.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.47 11.1 45.71 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.7 -0.762 . . . . 1.16 112.715 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 58.1 t30 -111.35 66.85 0.63 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.675 -0.491 . . . . 2.22 109.675 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.77 123.21 37.66 Favored Pre-proline 0 N--CA 1.464 0.229 0 CA-C-N 115.259 -0.882 . . . . 1.75 112.35 -172.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . 0.47 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 44.9 Cg_endo -69.48 155.04 67.98 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.985 2.457 . . . . 0.71 111.995 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.444 ' O ' HD11 ' A' ' 110' ' ' LEU . 80.6 p -83.79 173.92 10.88 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.933 -0.395 . . . . 2.17 109.933 176.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -65.08 -27.67 68.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.236 0.541 . . . . 3.31 109.807 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -72.8 -29.58 63.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.877 -0.601 . . . . 2.24 110.225 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.71 -44.1 97.58 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-O 121.292 0.567 . . . . 1.73 109.642 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.444 HD11 ' O ' ' A' ' 106' ' ' THR . 7.0 mp -65.18 -45.13 86.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.328 -0.851 . . . . 1.56 110.939 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -58.38 -42.02 86.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.173 0.511 . . . . 2.31 110.127 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.424 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -63.5 -42.94 98.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.721 -0.672 . . . . 1.19 111.412 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -63.26 -34.98 78.85 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.771 -0.372 . . . . 1.84 111.964 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 5.5 m -87.1 -27.3 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.221 0.534 . . . . 0.66 110.537 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 14.6 ptpt -71.07 -30.63 66.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.47 . . . . 2.26 110.973 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.603 ' O ' HD21 ' A' ' 120' ' ' LEU . 21.0 mt-10 -77.5 -36.19 52.8 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 119.839 -0.744 . . . . 2.27 110.63 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.2 m -66.41 -28.15 42.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 120.287 -0.565 . . . . 0.91 109.68 175.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.483 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.3 mt -73.92 -38.97 64.14 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.637 -0.505 . . . . 1.75 109.637 173.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -58.65 -49.2 78.42 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.438 -0.579 . . . . 1.51 109.438 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.603 HD21 ' O ' ' A' ' 116' ' ' GLU . 4.4 mm? -61.43 -46.81 88.54 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.662 -0.699 . . . . 1.68 112.052 173.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -32.12 64.51 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 118.513 -1.275 . . . . 2.2 111.862 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.079 0.466 . . . . 2.44 110.654 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.2 59.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.698 . . . . 1.16 112.577 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.524 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 60.6 mtm -72.71 151.03 42.4 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.662 -0.815 . . . . 1.15 110.042 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.3 p -63.43 150.32 43.9 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 1.57 110.145 173.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -55.55 -43.29 75.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.557 0.218 . . . . 2.21 111.501 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.31 -25.15 66.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.137 -0.483 . . . . 1.18 111.464 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.46 -36.1 24.34 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.87 -0.681 . . . . 0.35 111.646 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.465 ' HE3' ' O ' ' A' ' 124' ' ' MET . 98.5 mttt -63.14 -45.92 89.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.211 0.529 . . . . 1.84 110.502 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . 0.536 ' O ' ' HE3' ' A' ' 134' ' ' LYS . . . -66.89 -33.85 76.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.544 -0.753 . . . . 1.15 111.335 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -74.79 -32.26 61.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.914 0.388 . . . . 0.55 110.049 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.47 -32.36 71.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.968 -0.56 . . . . 0.49 110.088 172.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -67.14 -18.65 69.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.889 -0.596 . . . . 0.27 113.067 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.536 ' HE3' ' O ' ' A' ' 130' ' ' ALA . 23.2 mmtp -82.8 -29.37 29.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.468 0.651 . . . . 2.95 110.065 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.494 ' CG ' HD11 ' A' ' 77' ' ' LEU . 6.2 mm100 -96.23 -40.8 8.99 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.041 -0.981 . . . . 1.83 110.976 -174.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.63 ' HD2' ' CD1' ' A' ' 136' ' ' PHE . 70.5 m-85 -131.18 74.1 79.74 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.984 0.421 . . . . 0.91 109.958 176.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.8 -34.55 72.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.104 2.536 . . . . 1.06 112.621 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.539 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 47.8 t80 -64.58 -34.34 78.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.884 0.373 . . . . 2.9 110.616 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 86.6 mt -78.84 -47.43 16.63 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.845 -0.342 . . . . 1.67 110.375 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.03 -33.62 67.38 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.185 0.516 . . . . 1.04 109.777 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.8 tttp -51.09 -73.37 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.89 -1.05 . . . . 3.06 111.525 171.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.1 m -72.17 -13.76 16.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.346 -0.843 . . . . 0.5 112.91 -171.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.503 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.2 m-30 -80.21 -44.81 19.1 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.41 -0.516 . . . . 0.92 110.259 175.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.84 -43.05 84.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.861 -0.609 . . . . 2.58 110.386 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.4 m -76.85 156.83 31.9 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.96 -0.755 . . . . 1.81 108.96 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -79.28 48.74 3.43 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.509 -0.853 . . . . 1.41 112.763 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -100.64 -65.87 0.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.123 -0.325 . . . . 2.46 110.123 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.86 -38.38 90.8 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.061 0.458 . . . . 1.07 109.86 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.483 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -55.55 -44.73 77.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.292 -0.867 . . . . 1.12 110.763 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.05 -38.14 82.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 3.27 110.269 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 1.626 ' HE1' ' CE2' ' A' ' 151' ' ' PHE . 25.8 t80 -58.43 -41.85 85.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 0.68 110.255 177.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.99 63.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.741 -0.663 . . . . 1.18 111.769 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.691 0 N-CA-C 111.314 -0.714 . . . . 1.62 111.314 -175.254 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.469 0.652 . . . . 2.09 112.444 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -104.89 135.06 46.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.348 -0.842 . . . . 3.54 109.704 176.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 49.5 t80 -64.35 -39.93 94.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.08 -0.963 . . . . 2.56 112.621 -168.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -93.67 18.59 9.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.18 0.514 . . . . 4.16 111.131 -177.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -98.44 0.87 46.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.951 0.881 . . . . 2.57 109.092 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.9 mt -81.9 131.93 55.66 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.946 -1.025 . . . . 1.31 109.169 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.83 114.79 0.57 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.304 2.67 . . . . 0.7 112.349 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.65 66.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.772 -0.649 . . . . 1.23 111.481 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -65.21 -34.92 79.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.9 0.857 . . . . 1.37 109.697 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 1.612 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 90.7 t80 -82.81 -33.36 27.25 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.447 -1.252 . . . . 1.08 110.369 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.669 HH12 ' HH ' ' A' ' 3' ' ' TYR . 41.1 mtp85 -64.2 -24.86 67.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.324 0.583 . . . . 2.1 110.26 -178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -63.64 -27.02 68.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.02 110.866 176.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 mt -94.23 -19.25 20.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 1.49 110.971 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.533 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 91.5 mtp -65.73 131.29 94.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 1.65 111.653 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.51 137.1 71.71 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.657 2.238 . . . . 1.12 111.363 176.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.02 -31.24 43.35 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.618 2.878 . . . . 1.3 112.916 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -62.56 -49.5 75.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.075 0.464 . . . . 2.26 110.541 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.08 65.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.39 110.909 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -78.56 -44.38 24.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.786 -0.643 . . . . 2.54 111.307 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 32.2 t70 -51.71 -49.47 62.42 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.46 0.475 . . . . 1.06 112.195 -176.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 1.629 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 54.1 t80 -55.93 -58.49 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.378 -0.374 . . . . 0.73 111.728 177.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.458 HD22 HD22 ' A' ' 25' ' ' LEU . 80.1 mt -72.55 -13.11 61.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.894 0.77 . . . . 1.75 111.329 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.439 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 51.7 tt0 -65.01 -49.47 70.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.688 0.28 . . . . 2.56 110.957 167.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -86.84 -30.79 21.2 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.992 0.367 . . . . 1.84 111.992 -175.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.468 HD21 ' CE2' ' A' ' 21' ' ' PHE . 14.9 tp -67.54 131.25 45.29 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-O 121.328 0.585 . . . . 1.7 110.407 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.543 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 14.2 t -119.22 168.6 10.73 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.414 -0.812 . . . . 2.16 110.011 -172.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 0.8 OUTLIER -54.66 -44.4 73.25 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.335 0.865 . . . . 2.39 113.335 -169.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.83 -38.33 83.1 Favored Glycine 0 N--CA 1.454 -0.156 0 C-N-CA 120.833 -0.699 . . . . 1.47 111.938 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HB3' HD13 ' A' ' 59' ' ' LEU . 49.7 m-20 -79.61 -38.63 33.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.433 0.159 . . . . 2.25 110.626 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.543 ' HG3' ' O ' ' A' ' 26' ' ' SER . 82.1 mttt -54.65 -27.95 43.55 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.152 0.501 . . . . 1.89 110.237 176.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.7 m -59.36 -36.33 75.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.425 -0.807 . . . . 1.37 111.522 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.486 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 6.1 p -89.22 -24.58 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 116.211 -0.45 . . . . 0.85 110.794 -174.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.54 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.3 mm? -50.2 -52.01 39.28 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.345 -0.389 . . . . 1.65 111.318 173.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 46.2 pttt -66.19 -21.22 66.31 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.107 0.41 . . . . 2.89 112.107 -176.253 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -70.71 -27.99 64.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.159 0.504 . . . . 1.96 110.184 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.96 -51.89 16.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.726 . . . . 0.98 109.967 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 1.649 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 49.7 m-85 -60.71 -45.76 92.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.899 1.444 . . . . 1.08 114.899 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.9 -20.95 60.24 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.012 -0.675 . . . . 2.71 110.504 -177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.23 -76.6 0.13 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.903 -0.59 . . . . 1.57 109.907 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.32 -158.38 0.83 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.077 -0.582 . . . . 1.54 112.693 -176.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -95.03 138.01 5.9 Favored 'Cis proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.184 -1.173 . . . . 1.99 111.175 -9.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 41.7 m-85 -114.27 108.18 16.59 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.56 0.695 . . . . 1.72 110.916 -173.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.45 -8.93 29.33 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.435 -1.257 . . . . 4.11 111.0 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -137.79 163.54 31.11 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.617 -0.883 . . . . 1.53 108.617 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.9 m -85.33 -33.29 22.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.797 0.332 . . . . 1.72 110.379 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.408 ' HA ' HD13 ' A' ' 49' ' ' ILE . 6.1 mp0 -56.61 -34.28 67.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 2.24 111.702 179.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.6 OUTLIER -68.57 -38.07 80.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.74 0.305 . . . . 2.26 111.242 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.5 m -66.52 -39.34 88.57 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.507 -0.553 . . . . 1.69 109.507 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.439 HD11 ' HA ' ' A' ' 64' ' ' GLU . 97.0 mt -61.79 -44.66 99.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.254 -0.885 . . . . 1.2 110.108 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.77 -48.69 80.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 1.29 111.861 176.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.48 87.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.304 0.573 . . . . 1.21 110.214 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.46 HD22 HD11 ' A' ' 33' ' ' LEU . 29.0 mt -66.49 -38.06 86.44 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.184 -0.916 . . . . 1.13 111.331 178.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.49 ' HZ2' ' CD ' ' A' ' 64' ' ' GLU . 93.7 mttt -62.27 -39.44 92.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.838 0.351 . . . . 1.87 111.547 177.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -71.24 -44.62 64.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.41 -0.359 . . . . 3.57 111.123 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.486 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 25.3 mmtt -68.73 -48.79 62.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.125 -0.489 . . . . 2.01 111.931 177.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.2 m -145.4 96.9 4.78 Favored Pre-proline 0 C--N 1.313 -1.004 0 O-C-N 122.234 -0.291 . . . . 1.68 110.502 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -41.8 -56.79 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.809 3.006 . . . . 0.84 113.209 -170.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG2' ' HE3' ' A' ' 62' ' ' LYS . 37.0 tt0 -60.21 -35.41 75.36 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.533 -1.212 . . . . 2.45 112.436 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.44 HD13 ' HB3' ' A' ' 29' ' ' ASP . 62.1 mt -69.6 -40.61 76.56 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 119.406 -0.917 . . . . 2.03 109.05 -175.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.73 -38.43 96.18 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 114.311 -1.313 . . . . 0.41 111.691 176.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.9 95.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.745 0.307 . . . . 1.19 110.49 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.464 ' HE3' ' HG2' ' A' ' 58' ' ' GLU . 98.7 mttt -62.45 -58.73 6.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.013 -0.539 . . . . 2.7 110.913 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.88 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 1.12 111.425 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.49 ' CD ' ' HZ2' ' A' ' 53' ' ' LYS . 38.3 tt0 -67.0 -57.73 6.3 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 121.011 -0.276 . . . . 1.7 111.016 178.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.478 ' HB3' ' HZ2' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -64.67 -31.19 72.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.619 0.723 . . . . 4.35 109.706 -175.468 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 21' ' ' PHE . 21.5 tp -67.79 -38.15 82.95 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.707 -1.133 . . . . 2.09 110.49 177.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -79.36 -31.65 43.02 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.974 -0.75 . . . . 3.07 108.974 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.42 95.45 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.851 -1.068 . . . . 1.26 111.138 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.463 ' HE3' ' HA ' ' A' ' 66' ' ' LEU . 43.9 mtm -58.79 -55.72 31.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.892 -0.41 . . . . 1.21 109.892 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 95.2 t -50.93 -46.82 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 115.366 -0.834 . . . . 0.79 110.949 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.446 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 12.8 mtpt -66.17 -33.92 76.86 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.662 -0.699 . . . . 2.03 112.308 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.4 t -56.6 -41.56 77.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.086 0.47 . . . . 1.66 110.649 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.6 -45.33 68.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.963 -0.562 . . . . 2.14 110.061 177.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -67.94 -25.27 31.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.221 0.534 . . . . 1.1 110.889 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.27 -33.77 73.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.709 0.766 . . . . 1.18 109.939 173.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.01 -1.94 58.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.741 -1.118 . . . . 1.11 110.83 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.9 tp -93.95 137.97 32.58 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.731 -0.668 . . . . 1.34 109.894 -175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.97 149.28 51.46 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.393 -0.67 . . . . 0.76 112.037 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -37.95 -42.85 1.48 Allowed 'Trans proline' 0 N--CA 1.478 0.603 0 C-N-CA 124.666 3.577 . . . . 1.89 114.741 -176.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -70.14 -51.37 31.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.552 0.215 . . . . 2.52 110.683 -177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.49 -33.46 69.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.711 0.767 . . . . 1.13 109.825 -177.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -57.2 -45.92 83.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.401 -1.272 . . . . 2.52 110.927 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.24 97.93 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.654 -0.784 . . . . 0.46 111.738 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.508 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 6.5 t80 -62.49 -48.02 81.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.359 -0.237 . . . . 2.04 110.359 175.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -56.95 14.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.274 . . . . 1.07 111.385 -178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 30.3 mt-10 -62.7 -25.13 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 1.96 111.408 -174.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -86.75 -41.46 14.11 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.641 -0.254 . . . . 2.74 111.05 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.8 p -66.75 -39.47 87.92 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.683 -0.235 . . . . 0.65 111.158 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 51.7 mm -58.12 -40.14 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 110.077 -0.342 . . . . 1.79 110.077 176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 75.5 mm-40 -63.61 -34.49 77.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.11 -0.495 . . . . 2.82 111.246 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 53.2 mt -65.82 -49.6 76.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.777 0.323 . . . . 1.2 110.482 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.92 -36.01 79.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.683 -0.488 . . . . 1.23 109.683 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -56.91 -40.62 76.62 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.468 -0.787 . . . . 5.02 110.763 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.86 -36.47 82.03 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.899 -0.667 . . . . 0.72 112.46 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.4 mm -67.62 -49.59 68.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.256 0.551 . . . . 1.23 110.071 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.7 ptmm? -80.68 2.37 26.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 3.16 111.131 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.66 -26.37 27.83 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.89 -0.782 . . . . 1.33 108.89 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . 0.613 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.1 mtp180 -86.86 -1.56 57.89 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 3.64 109.866 174.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -90.84 -22.11 21.13 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.909 -0.404 . . . . 1.28 109.909 165.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 1.67 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 30.8 m-85 -84.82 -45.04 12.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.96 0.409 . . . . 1.78 110.731 176.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.568 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 16.7 p -70.17 -20.97 63.1 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.005 0.743 . . . . 1.51 113.005 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 98.28 1.47 58.07 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.762 -0.733 . . . . 1.16 112.789 -174.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASN . . . . . 0.613 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 51.3 m-80 -92.64 56.97 2.8 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 122.706 -0.29 . . . . 2.22 110.732 -178.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -43.72 123.21 3.81 Favored Pre-proline 0 N--CA 1.469 0.476 0 O-C-N 124.128 0.893 . . . . 1.75 112.374 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.0 155.52 38.4 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.946 2.431 . . . . 0.71 112.177 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -94.17 177.95 5.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.96 -0.756 . . . . 2.17 108.96 173.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.0 ptpp? -62.77 -31.14 72.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.036 -0.666 . . . . 3.31 110.86 -175.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -61.81 -38.28 87.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.605 -0.271 . . . . 2.24 110.777 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -63.54 -45.0 92.55 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.28 0.562 . . . . 1.73 110.3 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.24 -41.93 84.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.296 -0.865 . . . . 1.56 110.895 -178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 59.1 mtpt -60.98 -41.75 97.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.973 0.416 . . . . 2.31 110.021 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.55 -39.44 93.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.939 -0.573 . . . . 1.19 111.291 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 73.7 p -66.28 -33.6 76.11 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.392 0.515 . . . . 1.84 112.392 -177.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.433 ' CG2' ' HB3' ' A' ' 152' ' ' ALA . 6.2 m -85.85 -25.81 6.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.868 0.842 . . . . 0.66 109.404 -179.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 10.3 ttpt -61.5 -46.11 91.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.589 -1.187 . . . . 2.26 111.405 -178.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.465 ' O ' HD11 ' A' ' 120' ' ' LEU . 28.1 mt-10 -73.01 -33.88 66.03 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.666 -0.414 . . . . 2.27 111.793 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.13 -34.67 70.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.235 -0.586 . . . . 0.91 110.457 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.408 ' CD2' ' HB3' ' A' ' 149' ' ' ALA . 5.0 mp -76.79 -30.01 56.26 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.281 -0.568 . . . . 1.75 110.471 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -62.07 -38.21 87.92 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.168 -0.679 . . . . 1.51 109.168 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LEU . . . . . 0.465 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.1 mp -76.74 -47.5 21.61 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.234 -0.894 . . . . 1.68 111.925 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 1.669 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 12.9 t80 -72.76 -39.48 66.76 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.469 -0.493 . . . . 2.2 111.938 -168.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -65.42 -36.66 84.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.368 0.604 . . . . 2.44 110.142 178.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.57 -2.1 24.43 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.7 -1.136 . . . . 1.16 112.99 -176.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 74.0 mtm -78.63 153.05 31.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.494 -0.928 . . . . 1.15 108.494 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -53.43 -79.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.402 0.546 . . . . 1.57 111.083 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.493 ' HA ' ' HG2' ' A' ' 129' ' ' LYS . 24.0 t70 -168.78 -47.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.358 -0.214 . . . . 2.21 110.956 175.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.56 74.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.264 -0.425 . . . . 1.18 110.855 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.18 -40.75 28.45 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.444 -0.798 . . . . 0.35 112.685 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.493 ' HG2' ' HA ' ' A' ' 126' ' ' ASP . 4.5 ptpp? -70.81 -35.96 72.76 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.345 -0.542 . . . . 1.84 110.528 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.94 -23.43 60.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 1.15 110.699 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . 0.476 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 35.6 t70 -78.86 -32.33 45.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.55 109.653 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.39 -28.26 69.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.491 -0.777 . . . . 0.49 109.855 173.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.39 -16.73 69.68 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.27 113.211 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 64.8 mttt -86.34 -40.31 15.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 121.628 0.728 . . . . 2.95 109.643 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.44 -43.45 27.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.753 -1.112 . . . . 1.83 111.281 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' PHE . . . . . 1.664 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 65.7 m-85 -128.1 77.32 76.89 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.91 110.025 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.36 -36.5 44.71 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.319 2.68 . . . . 1.06 113.333 -172.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' PHE . . . . . 0.56 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 52.3 t80 -62.41 -40.77 97.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 2.9 111.373 -175.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 143' ' ' PHE . 92.2 mt -75.2 -45.6 39.41 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.855 -0.338 . . . . 1.67 110.651 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.88 71.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 1.04 110.291 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' LYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.9 tttt -52.42 -72.08 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 3.06 111.175 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.551 ' HB ' ' CB ' ' A' ' 147' ' ' LYS . 2.4 m -64.56 -31.71 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.195 -0.911 . . . . 0.5 113.004 -171.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 139' ' ' LEU . 21.3 m-30 -63.88 -29.05 70.27 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.983 0.421 . . . . 0.92 110.92 -177.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -91.19 -12.19 36.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.499 . . . . 2.58 111.558 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 26.4 t -118.24 46.88 1.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.19 0.519 . . . . 1.81 110.098 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 69.68 -99.6 0.68 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.9 -0.667 . . . . 1.41 111.607 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' LYS . . . . . 0.551 ' CB ' ' HB ' ' A' ' 142' ' ' VAL . 31.2 mmtm 48.12 -95.54 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 113.064 0.764 . . . . 2.46 113.064 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.24 90.38 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.054 0.454 . . . . 1.07 110.395 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ALA . . . . . 0.408 ' HB3' ' CD2' ' A' ' 118' ' ' LEU . . . -64.1 -43.14 96.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 1.12 110.295 176.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -66.26 -35.87 81.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.241 0.543 . . . . 3.27 110.176 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 56.6 t80 -62.29 -38.11 88.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.345 -0.843 . . . . 0.68 110.722 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ALA . . . . . 0.433 ' HB3' ' CG2' ' A' ' 114' ' ' VAL . . . -94.01 6.25 49.11 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.734 -0.666 . . . . 1.18 111.985 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.945 -1.262 . . . . 1.62 109.945 -175.403 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 20.2 ptp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.532 0.206 . . . . 23.66 110.593 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 134.54 -160.41 24.2 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.814 -0.707 . . . . 22.6 112.463 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 9.8 p -68.07 -13.16 61.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.545 0.338 . . . . 21.85 111.709 -178.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 7.5 p -68.21 -20.59 64.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.967 0.413 . . . . 20.32 110.853 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -92.02 8.03 39.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.553 0.692 . . . . 22.01 109.35 177.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -111.98 -173.55 2.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 18.73 109.779 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -61.22 153.46 26.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.805 0.336 . . . . 16.62 110.425 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . 0.434 ' O ' ' HB2' ' A' ' -6' ' ' HIS . 55.6 m-70 -112.52 153.44 27.46 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.297 -0.631 . . . . 13.55 109.297 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . 0.434 ' HB2' ' O ' ' A' ' -7' ' ' HIS . 44.4 m170 72.01 126.91 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 O-C-N 123.755 0.66 . . . . 12.8 111.189 -176.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -152.77 -35.96 0.11 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.181 -0.463 . . . . 11.87 110.972 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 15.3 m -123.7 12.87 9.26 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.95 -0.3 . . . . 7.99 111.318 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.3 m -136.18 10.8 3.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.731 0.3 . . . . 7.5 111.484 -178.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -108.04 -39.49 1.83 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.335 -0.936 . . . . 4.74 112.529 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -68.79 122.79 19.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 5.19 110.696 -178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.434 ' HG2' ' OD2' ' A' ' 27' ' ' ASP . 36.8 tpp -143.25 126.64 16.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.632 -0.713 . . . . 2.17 110.487 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.538 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 18.4 t80 -56.27 128.12 34.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.277 -0.874 . . . . 2.09 112.221 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -123.27 124.18 42.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.662 -0.699 . . . . 3.54 109.343 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.627 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 56.8 t80 -67.77 -17.61 64.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.276 0.56 . . . . 2.56 110.513 -175.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -82.59 -9.02 59.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.404 -0.816 . . . . 4.16 110.337 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -97.87 -7.63 29.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.074 -0.512 . . . . 2.57 110.799 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 52.5 mt -75.47 135.88 71.95 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.295 -0.632 . . . . 1.31 109.295 177.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.96 112.11 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.658 2.239 . . . . 0.7 111.508 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.4 -22.21 66.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 1.23 112.005 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.76 -30.88 71.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 122.023 0.916 . . . . 1.37 109.533 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.65 ' HE2' ' CE1' ' A' ' 10' ' ' TYR . 88.9 t80 -88.81 -26.25 21.79 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.037 -1.438 . . . . 1.08 110.736 -176.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -72.96 -19.58 61.21 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.681 0.753 . . . . 2.1 109.5 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -72.03 -23.74 61.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.694 -1.139 . . . . 1.02 110.421 172.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.494 HD22 ' CD ' ' A' ' 147' ' ' LYS . 86.8 mt -94.5 17.69 12.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.852 -0.613 . . . . 1.49 112.046 -175.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.442 ' SD ' ' HG2' ' A' ' 19' ' ' ARG . 19.4 ptp -128.08 145.16 54.29 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 120.795 -0.362 . . . . 1.65 110.046 177.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.456 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 31.9 Cg_exo -59.65 140.33 93.11 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.986 2.457 . . . . 1.12 112.316 -176.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.88 -34.18 90.84 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.964 3.11 . . . . 1.3 112.692 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.56 -39.38 93.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.619 -0.718 . . . . 2.26 110.366 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.22 -4.41 50.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 1.39 110.755 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 31.7 mtm180 -98.45 -38.77 9.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.986 -0.552 . . . . 2.54 110.162 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -48.78 -42.74 36.74 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.899 0.75 . . . . 1.06 111.275 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.663 ' HE1' ' CE2' ' A' ' 21' ' ' PHE . 61.5 t80 -56.76 -54.84 41.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.533 -0.758 . . . . 0.73 112.132 175.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.598 HD23 ' OH ' ' A' ' 100' ' ' TYR . 65.5 mt -79.53 -10.71 59.85 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.203 0.91 . . . . 1.75 111.266 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.26 -45.72 75.83 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.125 0.488 . . . . 2.56 110.795 162.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -88.81 -26.48 21.67 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.752 0.649 . . . . 1.84 112.752 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.484 HD22 ' CD2' ' A' ' 22' ' ' LEU . 4.8 tp -77.11 136.59 38.63 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-O 121.209 0.528 . . . . 1.7 110.431 -174.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.429 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 4.9 p -120.55 -179.18 3.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.525 -0.761 . . . . 2.16 111.738 -171.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.434 ' OD2' ' HG2' ' A' ' 0' ' ' MET . 1.5 m-20 -51.45 -52.17 48.62 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 2.39 112.955 -172.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.87 -42.05 78.21 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 116.226 -0.443 . . . . 1.47 113.31 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.42 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.8 m-20 -80.86 -36.16 31.75 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.795 -0.238 . . . . 2.25 111.169 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 26' ' ' SER . 96.8 mttt -55.86 -34.03 65.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.325 0.583 . . . . 1.89 110.448 177.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.7 m -55.53 -36.56 66.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.01 -0.996 . . . . 1.37 112.145 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.0 p -88.34 -21.47 6.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 111.978 0.362 . . . . 0.85 111.978 -171.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.419 HD21 ' HA ' ' A' ' 30' ' ' LYS . 4.2 mm? -52.99 -48.06 67.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.681 0.277 . . . . 1.65 111.193 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -64.22 -27.68 69.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.338 -0.392 . . . . 2.89 111.184 -175.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -68.52 -37.21 79.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.047 0.451 . . . . 1.96 110.052 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 93.4 t -72.62 -48.97 44.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.71 -0.677 . . . . 0.98 110.104 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.64 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 32.3 m-85 -57.0 -52.67 64.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.462 1.282 . . . . 1.08 114.462 176.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.63 -20.4 59.92 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.286 -0.566 . . . . 2.71 111.574 -171.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.64 -74.93 0.21 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.484 -0.325 . . . . 1.57 110.255 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.469 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.89 -157.16 1.19 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 121.017 -0.611 . . . . 1.54 112.968 -176.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -95.95 153.58 10.61 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 CA-C-N 118.536 1.168 . . . . 1.99 112.001 -7.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.469 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 27.7 m-85 -122.3 120.69 34.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 1.72 111.137 -171.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.61 -8.16 54.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.149 -0.932 . . . . 4.11 110.554 175.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -160.19 163.81 33.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.018 -0.734 . . . . 1.53 109.018 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.3 m -77.8 -22.77 49.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.776 -0.193 . . . . 1.72 111.509 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.83 -36.0 77.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 2.24 110.421 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 14.6 mm-40 -57.71 -40.85 80.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.136 0.493 . . . . 2.26 110.787 173.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.3 t -70.97 -36.05 72.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.772 -0.649 . . . . 1.69 109.846 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.76 -44.87 98.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.286 0.565 . . . . 1.2 109.745 176.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.56 -48.7 80.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.021 -0.991 . . . . 1.29 111.159 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.55 -40.65 87.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.324 0.583 . . . . 1.21 110.273 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.5 mt -67.65 -38.24 83.52 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.307 -0.861 . . . . 1.13 111.057 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -31.11 72.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.086 0.469 . . . . 1.87 110.995 177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -75.15 -46.8 31.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 3.57 110.946 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -82.79 -37.41 24.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.178 -0.465 . . . . 2.01 112.237 -175.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.7 t -144.49 87.95 7.42 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 109.472 -0.566 . . . . 1.68 109.472 176.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -41.42 -60.55 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 124.201 3.268 . . . . 0.84 113.9 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.55 -34.53 74.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.117 -0.947 . . . . 2.45 111.969 -178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.94 -36.81 78.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.061 -0.718 . . . . 2.03 109.061 -175.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.51 -35.34 91.92 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 114.664 -1.153 . . . . 0.41 111.668 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.99 -35.8 69.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.116 0.484 . . . . 1.19 110.384 175.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -64.2 -44.26 92.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 2.7 111.08 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.5 m -74.71 -30.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.944 -0.302 . . . . 1.12 110.765 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.67 -58.89 6.6 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.256 -0.429 . . . . 1.7 110.77 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.506 ' O ' ' HG3' ' A' ' 69' ' ' MET . 82.7 tttt -57.49 -37.49 73.02 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.476 0.655 . . . . 4.35 110.254 -176.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.498 ' HA ' ' HE3' ' A' ' 69' ' ' MET . 3.4 tm? -65.89 -45.69 81.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.02 -0.991 . . . . 2.09 109.958 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -78.3 -30.75 48.52 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.113 -0.699 . . . . 3.07 109.113 -172.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.78 -45.51 94.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.155 -0.929 . . . . 1.26 111.534 176.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.506 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 53.1 mtm -59.61 -48.36 81.95 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.381 0.61 . . . . 1.21 109.873 176.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.4 t -54.88 -45.53 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 114.915 -1.039 . . . . 0.79 110.611 177.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -63.61 -38.12 89.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 2.03 111.663 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.0 m -61.03 -37.48 82.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.082 0.468 . . . . 1.66 110.791 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 52.0 mttm -73.47 -48.17 35.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.833 -0.621 . . . . 2.14 110.003 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.501 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 81.1 mt -62.08 -20.62 24.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.665 0.745 . . . . 1.1 110.678 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.41 -27.81 61.66 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.394 -0.821 . . . . 1.18 109.793 177.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.35 0.79 57.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.402 -1.272 . . . . 1.11 110.279 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 132' ' ' PHE . 7.6 tp -96.02 140.34 30.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.726 -0.67 . . . . 1.34 110.634 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.86 160.21 53.18 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.998 -0.62 . . . . 0.76 112.158 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -48.04 -42.96 31.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.929 3.086 . . . . 1.89 113.657 -174.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.13 -45.19 74.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.601 -0.272 . . . . 2.52 110.966 -177.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.87 -30.83 40.35 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.002 -0.679 . . . . 1.13 110.297 -176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.501 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 41.1 ttmt -62.78 -40.72 98.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.625 -0.716 . . . . 2.52 110.704 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.5 -36.93 93.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.878 -0.677 . . . . 0.46 111.869 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -68.55 -46.5 69.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.192 . . . . 2.04 110.545 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.78 -55.24 36.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.74 0.305 . . . . 1.07 111.547 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -84.26 39.46 0.72 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 1.96 110.691 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.409 ' HD3' HD22 ' A' ' 120' ' ' LEU . 61.1 tttp -149.51 -43.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.681 -0.69 . . . . 2.74 109.285 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.7 p -67.31 -44.2 79.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.335 -0.393 . . . . 0.65 110.156 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 61.0 mt -64.06 -32.97 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-N 116.109 -0.496 . . . . 1.79 110.183 176.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -60.79 -35.72 77.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.968 0.413 . . . . 2.82 110.069 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.1 mt -72.22 -50.59 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 1.2 110.027 176.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.84 99.77 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.862 -0.608 . . . . 1.23 111.484 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.03 -37.08 84.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.749 -0.659 . . . . 5.02 110.006 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.38 -31.9 81.01 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 121.096 -0.573 . . . . 0.72 111.916 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.412 HD12 ' HB2' ' A' ' 113' ' ' SER . 30.8 mm -62.99 -53.54 45.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 1.23 110.667 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.44 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 55.7 pttt -84.36 3.44 35.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.204 -0.453 . . . . 3.16 110.904 -178.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.64 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -91.5 -34.56 14.74 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.779 -0.452 . . . . 1.33 109.779 170.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.481 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 7.3 ptp180 -83.68 -3.59 57.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.261 -0.644 . . . . 3.64 109.261 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.538 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.2 m-85 -79.33 -34.42 42.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.709 -0.478 . . . . 1.28 109.709 164.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.634 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 22.9 m-85 -67.62 -44.92 76.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.373 0.606 . . . . 1.78 110.642 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.479 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.6 p -66.22 -21.93 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.078 -0.964 . . . . 1.51 112.675 -174.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.75 1.03 56.36 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.871 -0.681 . . . . 1.16 112.067 -174.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -93.6 56.88 2.46 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.878 0.37 . . . . 2.22 110.02 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -55.7 119.36 24.76 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.495 -0.775 . . . . 1.75 111.98 -172.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.481 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 36.8 Cg_endo -67.38 146.81 76.28 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.409 2.739 . . . . 0.71 112.543 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -77.32 168.27 20.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.777 -0.453 . . . . 2.17 109.777 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -56.77 -32.65 65.84 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.473 0.654 . . . . 3.31 111.163 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -83.28 -14.57 52.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.561 -0.745 . . . . 2.24 111.468 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.447 ' HB3' ' HB2' ' A' ' 105' ' ' PRO . 12.2 t70 -68.04 -40.96 82.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.608 -0.515 . . . . 1.73 109.608 174.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -30.75 71.77 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.554 -0.748 . . . . 1.56 110.985 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -59.75 -46.55 88.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.607 -0.516 . . . . 2.31 109.607 176.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.067 -0.97 . . . . 1.19 110.821 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.412 ' HB2' HD12 ' A' ' 95' ' ' ILE . 33.5 t -53.38 -60.54 3.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 1.84 111.478 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 16.2 m -76.19 -24.02 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.014 0.435 . . . . 0.66 110.824 -172.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 155' ' ' ASN . 25.3 ttmm -54.94 -45.57 74.86 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.865 -0.607 . . . . 2.26 110.758 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.496 ' O ' HD11 ' A' ' 120' ' ' LEU . 31.7 mt-10 -75.03 -31.99 61.48 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.313 -0.555 . . . . 2.27 111.108 -178.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.3 m -65.29 -32.67 59.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 119.647 -0.821 . . . . 0.91 109.92 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.458 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 83.0 mt -75.35 -36.4 61.0 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.416 . . . . 1.75 109.878 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.408 ' HA ' ' OD1' ' A' ' 155' ' ' ASN . 36.5 ttpt -60.13 -38.09 82.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.467 0.651 . . . . 1.51 109.486 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.496 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -78.7 -44.51 23.41 Favored 'General case' 0 N--CA 1.438 -1.025 0 CA-C-N 115.136 -0.938 . . . . 1.68 112.073 174.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.656 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 16.4 t80 -72.91 -32.44 65.33 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 119.476 -0.89 . . . . 2.2 111.759 -169.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -66.78 -32.73 74.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.084 0.469 . . . . 2.44 110.632 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.85 -9.52 59.28 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.775 0.657 . . . . 1.16 112.775 -174.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.0 mtm -75.07 154.7 37.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.317 -0.553 . . . . 1.15 110.608 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.3 m -64.4 143.72 57.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.11 -0.33 . . . . 1.57 110.11 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.68 -45.93 63.63 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.317 0.488 . . . . 2.21 112.317 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.97 -33.34 73.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.89 0.376 . . . . 1.18 111.032 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -75.03 -35.24 50.33 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.536 -0.626 . . . . 0.35 111.536 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.65 -43.13 94.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.197 0.522 . . . . 1.84 109.617 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.57 -29.86 66.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.53 -0.759 . . . . 1.15 111.467 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -75.19 -30.62 60.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.071 0.462 . . . . 0.55 109.803 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.425 ' HA ' HD12 ' A' ' 77' ' ' LEU . 90.8 t80 -61.65 -27.21 68.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.604 . . . . 0.49 110.162 172.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.82 -3.35 73.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.942 -0.646 . . . . 0.27 113.052 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -96.54 -39.94 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.481 0.657 . . . . 2.95 109.915 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -86.39 -32.42 20.94 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.884 -1.053 . . . . 1.83 110.634 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.667 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 53.1 m-85 -136.24 73.1 58.23 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.994 0.426 . . . . 0.91 110.951 174.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.99 -36.72 81.41 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.287 2.658 . . . . 1.06 112.942 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.65 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 38.2 t80 -61.71 -40.08 93.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.508 -0.314 . . . . 2.9 110.878 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -77.37 -43.22 33.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 1.67 110.604 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.07 -40.07 73.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 1.04 109.947 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.497 ' HE3' ' HA ' ' A' ' 141' ' ' LYS . 0.0 OUTLIER -44.95 -68.06 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.955 -1.02 . . . . 3.06 111.613 173.449 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.473 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.0 OUTLIER -65.0 -22.77 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.229 -0.896 . . . . 0.5 112.132 -174.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -78.99 -38.92 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.191 -0.604 . . . . 0.92 110.739 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 49.6 mt-10 -71.09 -43.85 66.88 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.908 0.385 . . . . 2.58 110.316 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.0 m -69.78 -20.0 63.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.742 -0.663 . . . . 1.81 111.059 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 86.07 15.34 65.09 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.767 -0.73 . . . . 1.41 112.583 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.494 ' CD ' HD22 ' A' ' 13' ' ' LEU . 0.7 OUTLIER -63.02 -42.92 99.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.491 -0.559 . . . . 2.46 109.491 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -69.93 -32.75 71.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 1.07 110.298 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.458 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -60.84 -41.67 96.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.839 -0.618 . . . . 1.12 111.052 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -71.38 -8.97 57.26 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.842 0.353 . . . . 3.27 111.512 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.662 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 32.7 t80 -93.99 -40.53 10.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.945 0.402 . . . . 0.68 109.953 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -77.18 -24.59 51.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.823 -0.626 . . . . 1.18 112.362 -178.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 93.09 32.84 7.62 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.012 -1.235 . . . . 1.62 110.012 -169.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.09 84.21 0.1 Allowed 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.971 0.908 . . . . 4.12 110.829 -176.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.615 ' O ' ' HG3' ' A' ' 115' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.848 0 CA-C-N 115.028 -0.987 . . . . 4.01 109.483 -174.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.701 0.286 . . . . 23.66 110.91 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 80.79 -102.34 2.12 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 111.156 -0.778 . . . . 22.6 111.156 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 46.5 m -81.57 93.33 6.68 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.918 0.39 . . . . 21.85 110.046 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 17.6 m -68.48 -63.67 1.01 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.073 -0.512 . . . . 20.32 109.839 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 44.25 60.66 2.7 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.06 -0.973 . . . . 22.01 112.146 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -135.42 139.94 44.53 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.046 -0.724 . . . . 18.73 109.046 174.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . 0.461 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 9.2 p80 -114.11 -27.54 7.63 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.081 0.771 . . . . 16.62 113.081 -167.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -82.46 20.39 1.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.223 -0.591 . . . . 13.55 111.993 -171.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -99.34 -27.27 13.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.474 -0.33 . . . . 12.8 110.81 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -100.05 121.07 40.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.188 0.518 . . . . 11.87 111.532 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.7 m -158.57 80.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.731 -0.668 . . . . 7.99 109.634 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.5 p -94.17 -13.81 26.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.902 0.382 . . . . 7.5 111.483 -177.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 156.81 -25.41 0.5 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.604 -0.808 . . . . 4.74 111.945 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -87.06 137.63 32.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.856 -0.794 . . . . 5.19 108.856 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' A' ' 0' ' ' MET . 1.1 pmm? -78.03 -166.83 0.87 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.495 -0.321 . . . . 2.17 110.985 -176.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 9.3 p90 -53.73 151.82 5.88 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.364 0.602 . . . . 2.09 111.705 -176.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 71.8 mmtt -111.14 171.88 7.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.712 -0.676 . . . . 3.54 109.369 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.66 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 75.7 t80 -61.81 -50.44 72.28 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.153 0.502 . . . . 2.56 109.971 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -74.3 -6.43 47.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 4.16 111.883 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.461 ' OD1' ' HB2' ' A' ' -8' ' ' HIS . 11.7 t70 -78.88 -29.61 44.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.294 -0.632 . . . . 2.57 109.294 -177.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.8 mt -69.31 135.6 88.9 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.625 -0.716 . . . . 1.31 109.093 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -45.46 119.72 2.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.259 2.639 . . . . 0.7 112.28 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.24 -18.66 65.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 1.23 112.123 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.68 -33.72 75.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.984 0.897 . . . . 1.37 109.251 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.665 ' HE2' ' CE1' ' A' ' 10' ' ' TYR . 52.8 t80 -82.61 -29.32 30.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 113.99 -1.459 . . . . 1.08 111.26 -176.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.416 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 18.5 mtm180 -71.98 -18.08 62.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.455 0.645 . . . . 2.1 109.483 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.61 -27.24 63.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.727 -1.124 . . . . 1.02 110.634 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.453 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 71.8 mt -77.26 -51.54 10.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.976 -0.557 . . . . 1.49 111.385 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.419 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 25.3 ptt? -75.3 136.9 71.83 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 1.65 111.515 -174.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 31.7 Cg_exo -59.68 159.8 23.16 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.534 2.823 . . . . 1.12 112.957 -177.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -53.34 -31.41 56.87 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.55 2.833 . . . . 1.3 112.952 -178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.488 ' O ' HD22 ' A' ' 66' ' ' LEU . 43.8 mt-10 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.816 0.341 . . . . 2.26 110.564 177.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -21.32 66.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.319 -0.401 . . . . 1.39 111.187 -178.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.748 ' HB3' ' HH ' ' A' ' 3' ' ' TYR . 20.0 mtm180 -88.39 -31.18 18.98 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.955 -0.566 . . . . 2.54 110.715 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -52.15 -51.23 59.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.99 -0.55 . . . . 1.06 111.262 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.633 ' HE1' ' CE2' ' A' ' 21' ' ' PHE . 66.6 t80 -55.41 -61.56 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.73 111.627 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 59.9 mt -74.46 -9.19 58.35 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 119.108 0.867 . . . . 1.75 111.944 -176.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.35 -40.24 77.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.192 0.52 . . . . 2.56 109.989 163.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.88 -47.11 40.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.446 -0.797 . . . . 1.84 111.074 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.595 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.9 mm? -59.85 141.54 55.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.4 0.619 . . . . 1.7 111.202 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.6 t -116.14 -63.76 1.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.431 -0.804 . . . . 2.16 110.314 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -176.02 -47.83 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.134 0.271 . . . . 2.39 111.432 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.61 -34.64 79.1 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.519 -0.848 . . . . 1.47 111.305 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -36.93 69.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 2.25 109.946 173.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 88.5 mttt -61.64 -26.88 68.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.329 -0.85 . . . . 1.89 111.61 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.7 m -64.64 -35.67 81.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 1.37 110.35 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.6 t -66.27 -41.03 88.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.85 110.715 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.564 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.4 mm? -56.77 -46.27 81.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.915 0.388 . . . . 1.65 110.417 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -55.88 -43.21 76.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 2.89 111.681 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -69.86 -33.2 71.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 1.96 111.407 -178.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.467 ' CG1' ' HH ' ' A' ' 42' ' ' TYR . 67.6 t -75.59 -51.27 21.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.98 110.8 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.403 ' HB3' ' CG2' ' A' ' 101' ' ' THR . 14.6 m-85 -48.14 -50.61 28.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.791 1.034 . . . . 1.08 113.791 174.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -73.73 -25.55 60.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.115 -0.634 . . . . 2.71 111.571 -175.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.56 -79.16 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.17 -0.308 . . . . 1.57 110.17 174.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.531 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.43 -148.23 3.41 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.749 -0.739 . . . . 1.54 112.395 -173.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.5 149.82 12.9 Favored 'Cis proline' 0 N--CA 1.454 -0.813 0 CA-C-N 118.734 1.267 . . . . 1.99 111.116 -8.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.531 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 18.0 m-85 -118.44 128.12 54.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.485 0.659 . . . . 1.72 111.62 -170.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -86.89 -15.15 39.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.67 -1.15 . . . . 4.11 108.314 175.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -150.71 150.52 31.16 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.079 -1.082 . . . . 1.53 108.079 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.549 HG22 ' NE2' ' A' ' 67' ' ' HIS . 4.7 m -77.04 -16.12 59.38 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.87 -0.332 . . . . 1.72 111.694 -171.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -62.45 -26.88 68.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 2.24 110.21 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.7 mt-10 -65.09 -41.37 95.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 2.26 110.583 173.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 41.2 t -69.17 -41.46 77.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.143 0.496 . . . . 1.69 110.046 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 98.0 mt -61.01 -44.33 97.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.674 -0.694 . . . . 1.2 110.057 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -51.42 69.54 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 1.29 111.661 174.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -56.93 -43.16 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 1.21 110.718 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.411 HD22 HD11 ' A' ' 33' ' ' LEU . 45.9 mt -68.36 -34.03 75.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.298 -0.864 . . . . 1.13 111.241 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.09 -28.52 68.25 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.739 0.304 . . . . 1.87 111.222 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -76.52 -45.13 32.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.035 0.445 . . . . 3.57 110.739 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 31.1 mmmt -67.27 -46.77 72.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.865 -0.607 . . . . 2.01 111.149 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.417 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 22.9 t -149.5 102.18 3.29 Favored Pre-proline 0 C--N 1.315 -0.919 0 C-N-CA 120.818 -0.353 . . . . 1.68 110.327 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 4.4 Cg_endo -47.09 -59.62 1.18 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 123.581 2.854 . . . . 0.84 113.346 -168.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.16 -28.04 66.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.578 -0.737 . . . . 2.45 111.283 -177.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -40.36 81.47 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.241 -1.022 . . . . 2.03 108.241 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.81 -23.08 65.08 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.365 -1.289 . . . . 0.41 112.156 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.72 -31.1 66.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.867 0.365 . . . . 1.19 110.733 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.63 -47.23 76.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.289 -0.414 . . . . 2.7 110.539 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.39 -29.0 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 1.12 110.736 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 4.9 tm-20 -60.79 -55.17 36.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.692 -0.686 . . . . 1.7 110.239 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.5 ptmm? -62.52 -30.28 71.17 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-O 121.148 0.499 . . . . 4.35 109.911 -176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.495 ' HG ' ' HB2' ' A' ' 21' ' ' PHE . 0.2 OUTLIER -72.49 -1.45 15.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.514 -0.766 . . . . 2.09 111.274 -176.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.629 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 67.5 m80 -118.88 -46.79 2.53 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.241 -0.436 . . . . 3.07 110.821 175.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.42 -43.41 83.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.612 0.227 . . . . 1.26 111.612 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.433 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 33.8 mtm -61.2 -41.34 96.66 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.474 0.654 . . . . 1.21 110.237 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.0 t -71.39 -40.41 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.211 -0.904 . . . . 0.79 110.76 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 30.4 mmmt -60.55 -34.93 74.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.735 -0.666 . . . . 2.03 111.018 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.3 m -60.2 -33.0 71.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.289 0.566 . . . . 1.66 111.135 177.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.2 mttp -82.24 -42.59 18.7 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.562 -0.744 . . . . 2.14 110.194 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -69.6 -24.07 26.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.213 0.53 . . . . 1.1 111.055 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.0 -26.82 64.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.945 0.879 . . . . 1.18 109.558 174.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.34 2.5 55.82 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.32 -1.309 . . . . 1.11 110.101 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' A' ' 132' ' ' PHE . 12.1 tp -96.44 136.35 37.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.533 -0.758 . . . . 1.34 109.958 -175.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.5 153.05 51.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.592 -0.813 . . . . 0.76 112.32 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -42.53 -41.31 7.91 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 124.558 3.505 . . . . 1.89 113.518 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -64.01 -49.52 72.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.948 -0.569 . . . . 2.52 110.787 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.535 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.05 -31.91 34.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.904 -0.589 . . . . 1.13 110.664 -176.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -56.02 -48.03 76.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 2.52 110.881 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.04 -40.0 94.99 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.819 -0.705 . . . . 0.46 111.917 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.444 ' CE2' ' HB2' ' A' ' 121' ' ' TYR . 4.9 t80 -69.37 -44.23 71.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.74 -0.23 . . . . 2.04 111.08 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.38 -49.72 76.24 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.089 0.471 . . . . 1.07 111.047 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -67.32 -14.23 62.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.611 -0.722 . . . . 1.96 111.058 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -94.53 -46.5 6.95 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.476 -0.329 . . . . 2.74 110.691 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 p -65.25 -34.22 77.83 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.321 -0.4 . . . . 0.65 110.728 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.413 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 17.7 mt -55.77 -46.05 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 115.979 -0.555 . . . . 1.79 110.745 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.775 0.322 . . . . 2.82 110.989 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.63 -51.81 47.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 1.2 110.351 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.12 68.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 1.23 110.934 -178.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.475 ' NH2' HD13 ' A' ' 66' ' ' LEU . 4.4 mpt_? -69.7 -32.79 71.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.938 -0.574 . . . . 5.02 110.28 173.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -65.61 -38.73 94.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.155 -0.545 . . . . 0.72 112.081 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.411 HD12 ' CB ' ' A' ' 113' ' ' SER . 38.9 mm -56.64 -51.04 71.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.26 0.552 . . . . 1.23 110.129 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.463 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.2 mppt? -93.8 28.64 2.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.807 -0.633 . . . . 3.16 110.181 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -108.1 -33.66 7.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.457 -0.942 . . . . 1.33 108.457 164.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.505 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 5.2 ptp180 -86.17 -9.65 56.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.543 -0.753 . . . . 3.64 109.995 175.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.463 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 12.9 m-85 -77.38 -29.97 53.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.112 -0.699 . . . . 1.28 109.112 163.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.659 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 2.5 m-85 -83.94 -52.77 6.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.515 -0.766 . . . . 1.78 111.994 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.505 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 10.5 p -59.12 -26.3 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.299 0.852 . . . . 1.51 113.299 -173.012 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 108.89 39.31 1.73 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.699 -0.762 . . . . 1.16 113.608 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.501 ' OD1' ' HB2' ' A' ' 98' ' ' ARG . 4.5 p30 -149.08 68.8 1.05 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.33 0.586 . . . . 2.22 109.995 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -45.12 125.89 5.53 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 114.834 -1.075 . . . . 1.75 111.944 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.473 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 58.1 Cg_endo -74.19 155.35 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.989 2.459 . . . . 0.71 111.937 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 171.63 8.96 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.145 -0.687 . . . . 2.17 109.145 173.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -62.01 -29.8 70.51 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.388 -0.525 . . . . 3.31 110.646 -176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.36 -31.31 72.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.879 -0.6 . . . . 2.24 110.863 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.99 -46.81 70.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.375 -0.375 . . . . 1.73 110.292 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.0 mp -63.81 -43.1 97.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 1.56 110.031 176.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 151' ' ' PHE . 41.8 tttp -52.6 -53.29 48.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.651 -0.704 . . . . 2.31 110.528 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.445 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -62.65 -39.25 93.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.284 -0.871 . . . . 1.19 111.592 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.411 ' CB ' HD12 ' A' ' 95' ' ' ILE . 49.4 m -67.48 -44.5 78.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.841 0.682 . . . . 1.84 112.841 -178.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 2.9 m -71.27 -28.38 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 N-CA-C 108.607 -0.886 . . . . 0.66 108.607 -179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 84.4 tttt -53.62 -39.17 64.71 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.295 . . . . 2.26 111.25 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.591 ' O ' HD11 ' A' ' 120' ' ' LEU . 25.3 mt-10 -73.72 -36.82 65.24 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 120.113 -0.635 . . . . 2.27 111.322 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 1.8 m -64.77 -31.92 55.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 C-N-CA 119.98 -0.688 . . . . 0.91 110.459 179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 6.8 mp -80.05 -31.76 39.45 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.768 -0.583 . . . . 1.75 110.483 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -55.12 -42.7 73.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.852 0.834 . . . . 1.51 109.369 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.591 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -77.37 -47.02 20.97 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.45 -1.25 . . . . 1.68 112.11 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.656 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 20.6 t80 -70.33 -33.75 71.85 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 119.61 -0.836 . . . . 2.2 111.775 -170.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -66.82 -30.6 70.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 2.44 111.174 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -84.84 -7.27 59.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.756 -0.656 . . . . 1.16 112.604 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.535 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 58.7 mtm -74.53 158.44 33.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.506 -0.478 . . . . 1.15 110.951 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 7.3 m -65.07 145.72 55.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.45 -0.341 . . . . 1.57 110.282 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.75 -47.25 70.84 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.01 0.374 . . . . 2.21 112.01 -173.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.86 -27.46 69.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 1.18 110.992 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.48 -34.22 29.29 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.743 -0.543 . . . . 0.35 111.743 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -66.78 -45.04 79.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 1.84 109.98 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 134' ' ' LYS . . . -68.7 -26.44 65.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.367 -0.833 . . . . 1.15 110.691 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.443 ' OD2' HD13 ' A' ' 77' ' ' LEU . 24.6 t70 -78.28 -29.28 47.87 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.209 -0.663 . . . . 0.55 109.209 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.459 ' HA ' HD12 ' A' ' 77' ' ' LEU . 84.2 t80 -66.4 -34.05 77.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 0.49 110.189 173.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.31 -13.96 65.79 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.933 -0.651 . . . . 0.27 112.704 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 130' ' ' ALA . 58.2 mttm -91.17 -16.69 27.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.224 0.535 . . . . 2.95 110.529 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 57.2 mm-40 -110.87 -35.92 5.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.617 -0.72 . . . . 1.83 110.27 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -122.68 76.41 47.01 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.589 -0.523 . . . . 0.91 109.589 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.14 -30.32 46.86 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.828 2.352 . . . . 1.06 113.074 -172.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.663 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 11.9 m-85 -77.76 -36.06 51.07 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.186 0.439 . . . . 2.9 112.186 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.403 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.3 mt -71.81 -47.53 52.67 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 119.904 -0.718 . . . . 1.67 109.716 177.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.42 72.63 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.054 0.454 . . . . 1.04 110.051 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 84.1 tttt -50.25 -73.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.272 -0.876 . . . . 3.06 111.19 171.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.7 m -65.39 -25.54 37.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.336 -0.847 . . . . 0.5 112.667 -172.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.403 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 20.0 m-30 -69.5 -50.79 41.89 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.557 -0.457 . . . . 0.92 110.606 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.7 -28.75 64.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 2.58 111.425 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.1 m -76.56 -9.45 58.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.02 0.438 . . . . 1.81 110.729 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 78.56 17.65 77.21 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 121.128 -0.558 . . . . 1.41 112.621 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.453 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 0.8 OUTLIER -74.27 -51.73 14.43 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.407 -0.59 . . . . 2.46 109.407 -178.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.6 -33.85 76.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.132 0.492 . . . . 1.07 110.166 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -60.58 -35.6 76.47 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.537 -0.756 . . . . 1.12 110.781 176.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -73.23 -34.65 66.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.046 0.45 . . . . 3.27 110.483 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.467 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 38.1 t80 -63.56 -45.11 92.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 0.68 109.705 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -75.07 -22.24 58.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.858 -0.61 . . . . 1.18 111.519 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 116.88 -73.45 0.28 Allowed Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.282 -1.127 . . . . 1.62 110.282 -175.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -176.79 67.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.136 -1.061 . . . . 4.12 108.136 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.431 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 58.6 t30 . . . . . 0 C--O 1.246 0.884 0 CA-C-N 114.016 -1.447 . . . . 4.01 111.494 -171.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 110.019 -0.363 . . . . 23.66 110.019 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 76.06 -98.38 1.21 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.743 -0.741 . . . . 22.6 111.997 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 9.3 t -89.17 56.59 3.72 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.261 0.553 . . . . 21.85 109.788 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 15.5 m -122.61 47.78 1.88 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 20.32 110.369 -179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -79.4 93.77 5.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.926 -0.579 . . . . 22.01 109.517 178.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -70.1 105.38 2.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.967 -0.56 . . . . 18.73 112.054 -173.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -81.87 86.99 6.41 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.855 -0.795 . . . . 16.62 108.855 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -68.59 140.38 55.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.725 -0.671 . . . . 13.55 111.712 -171.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 68.26 166.15 0.25 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.473 -0.785 . . . . 12.8 112.203 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -75.2 90.08 2.55 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.505 -0.77 . . . . 11.87 110.057 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 47.0 t 63.83 70.13 0.52 Allowed 'General case' 0 C--N 1.33 -0.266 0 O-C-N 123.733 0.646 . . . . 7.99 110.743 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 38.0 t -73.53 -33.72 64.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.957 -0.757 . . . . 7.5 108.957 174.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -124.13 -92.21 0.98 Allowed Glycine 0 N--CA 1.44 -1.039 0 CA-C-N 115.114 -0.948 . . . . 4.74 111.127 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 6.1 t60 57.71 42.78 23.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.386 0.612 . . . . 5.19 109.68 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 11.0 tpt -138.82 110.82 7.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.761 -0.654 . . . . 2.17 110.186 -178.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.697 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 67.8 t80 -68.59 131.34 45.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.944 -0.571 . . . . 2.09 110.908 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.438 ' C ' ' HZ2' ' A' ' 30' ' ' LYS . 28.8 mtmm -120.86 -83.15 0.66 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.283 -0.417 . . . . 3.54 111.018 174.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.639 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 47.4 t80 167.25 -42.74 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.669 -0.863 . . . . 2.56 108.669 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.449 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 52.7 mt-10 -66.49 -18.88 65.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.932 -1.031 . . . . 4.16 110.685 175.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.75 -5.34 57.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.522 . . . . 2.57 111.193 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mt -80.84 137.16 50.53 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 108.702 -0.851 . . . . 1.31 108.702 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -46.9 115.39 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.709 2.272 . . . . 0.7 111.716 176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.86 -20.55 65.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.043 -0.526 . . . . 1.23 111.209 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.03 -35.92 82.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.648 0.737 . . . . 1.37 110.097 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.599 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 77.7 t80 -83.66 -29.16 27.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.688 -1.142 . . . . 1.08 111.414 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.449 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 20.9 mtm180 -69.23 -20.85 63.96 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.508 0.671 . . . . 2.1 109.427 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -68.16 -15.14 63.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.597 -1.183 . . . . 1.02 110.473 175.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.3 mt -104.27 -0.46 28.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 1.49 110.827 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.5 mtt -81.67 130.32 61.82 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.605 -0.271 . . . . 1.65 111.281 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -56.43 138.59 84.65 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.731 2.287 . . . . 1.12 111.505 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.26 -29.37 90.15 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.53 2.82 . . . . 1.3 112.79 -173.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -70.48 -49.08 52.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.233 -0.44 . . . . 2.26 110.083 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.9 71.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 1.39 110.956 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -67.87 -40.64 83.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 2.54 111.022 177.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -52.88 -46.03 67.76 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.397 0.436 . . . . 1.06 111.278 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.647 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 30.9 t80 -57.74 -61.0 2.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 0.73 111.265 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.474 HD13 ' HH ' ' A' ' 100' ' ' TYR . 8.2 mp -72.69 -8.25 54.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.994 0.816 . . . . 1.75 112.261 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -70.68 -57.35 4.78 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.852 0.358 . . . . 2.56 110.986 163.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.22 -37.07 33.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.036 -0.529 . . . . 1.84 111.905 -171.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.699 ' CD1' ' HB2' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -63.89 137.19 57.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 109.653 -0.499 . . . . 1.7 109.653 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.7 p -123.95 179.37 4.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.456 -0.338 . . . . 2.16 111.77 -170.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -56.45 -41.06 75.86 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.845 0.683 . . . . 2.39 112.845 -171.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.16 -34.06 82.49 Favored Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.727 -0.749 . . . . 1.47 112.481 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.699 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -85.0 -33.82 22.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.979 0.419 . . . . 2.25 109.887 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HZ2' ' C ' ' A' ' 2' ' ' LYS . 87.0 mttt -66.98 -10.8 53.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.557 0.694 . . . . 1.89 109.99 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 90.6 m -74.2 -31.94 62.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.871 -1.059 . . . . 1.37 110.486 174.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.636 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 10.2 p -87.14 -28.82 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 120.671 -0.411 . . . . 0.85 110.913 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.406 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.3 mm? -52.19 -48.7 64.89 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.348 0.118 . . . . 1.65 111.182 174.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -63.84 -34.18 77.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.767 0.318 . . . . 2.89 111.438 -178.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -68.9 -39.61 79.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.375 -0.375 . . . . 1.96 110.84 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.98 -43.81 38.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-O 121.177 0.513 . . . . 0.98 111.103 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.596 ' HE2' ' CE1' ' A' ' 37' ' ' PHE . 20.0 m-85 -60.2 -33.74 72.66 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 113.661 0.986 . . . . 1.08 113.661 174.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -92.52 9.39 34.71 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.656 -0.818 . . . . 2.71 110.547 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -101.97 -78.9 0.53 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.334 -0.848 . . . . 1.57 108.887 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.533 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.59 -151.35 3.03 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.85 -0.691 . . . . 1.54 112.808 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.409 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.29 130.92 5.83 Favored 'Cis proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.163 -1.182 . . . . 1.99 110.916 -9.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.533 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 19.5 m-85 -105.55 120.29 41.27 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.438 -0.801 . . . . 1.72 111.31 -170.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -73.14 -16.86 61.44 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.089 -0.96 . . . . 4.11 110.212 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.424 HD22 ' HG3' ' A' ' 47' ' ' GLU . 6.9 p30 -144.39 174.54 10.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.233 -0.439 . . . . 1.53 110.17 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.7 m -75.89 -37.05 59.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 1.72 111.165 -177.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -60.16 -35.24 74.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.023 -0.535 . . . . 2.24 112.321 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.447 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.8 mt-10 -61.28 -36.63 80.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.895 0.378 . . . . 2.26 110.985 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 30.0 t -74.34 -34.91 63.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.853 -0.425 . . . . 1.69 109.853 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.6 mt -62.92 -42.26 95.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.561 0.696 . . . . 1.2 109.6 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.85 76.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.667 -1.151 . . . . 1.29 111.802 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.05 79.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.087 -0.506 . . . . 1.21 110.896 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.99 -40.32 83.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 1.13 110.855 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -62.38 -34.71 77.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.692 0.282 . . . . 1.87 111.657 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -66.23 -44.48 83.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.437 . . . . 3.57 110.84 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.636 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 8.5 tppt? -77.11 -56.32 4.67 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.937 0.398 . . . . 2.01 110.543 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 m -125.34 103.99 28.9 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-O 121.51 0.671 . . . . 1.68 109.992 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.63 -56.21 1.63 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.635 2.89 . . . . 0.84 113.361 -170.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.501 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 48.6 mm-40 -73.88 -24.27 59.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.802 -0.636 . . . . 2.45 111.084 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.555 ' HG ' ' HB3' ' A' ' 29' ' ' ASP . 0.9 OUTLIER -71.05 -42.92 68.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.813 -0.81 . . . . 2.03 108.813 -178.078 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.62 -24.36 76.95 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.392 -1.276 . . . . 0.41 111.619 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.02 74.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.809 0.337 . . . . 1.19 110.82 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 66.9 mttm -60.56 -54.7 42.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.956 -0.565 . . . . 2.7 110.72 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.78 -30.21 49.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 1.12 110.958 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -61.36 -60.37 3.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.279 -0.419 . . . . 1.7 111.164 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 69' ' ' MET . 91.5 mttt -62.52 -33.2 74.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 4.35 110.345 -176.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.553 HD21 ' HB2' ' A' ' 21' ' ' PHE . 34.2 tp -64.9 -41.3 95.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.352 -0.84 . . . . 2.09 110.602 176.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -72.66 -32.09 65.59 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.955 -0.757 . . . . 3.07 108.955 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.53 -36.02 76.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.409 -1.269 . . . . 1.26 111.526 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 44.2 mtm -65.59 -51.28 60.93 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.262 0.553 . . . . 1.21 110.137 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.47 -39.68 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.312 -0.858 . . . . 0.79 110.094 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tpmt? -60.06 -40.39 89.3 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.615 -0.721 . . . . 2.03 110.439 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -61.64 -38.13 86.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.05 0.452 . . . . 1.66 110.685 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -75.55 -47.19 27.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.052 -0.522 . . . . 2.14 110.341 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.2 mt -63.2 -20.96 27.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.586 0.708 . . . . 1.1 110.388 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.29 -30.73 63.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.2 -0.909 . . . . 1.18 110.005 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.1 -3.2 58.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.44 -1.254 . . . . 1.11 110.008 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 tp -91.95 130.54 37.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.241 -0.89 . . . . 1.34 109.596 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.91 155.25 50.65 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.84 -0.695 . . . . 0.76 111.741 -178.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -44.37 -40.19 12.96 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.659 2.906 . . . . 1.89 114.073 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -62.46 -41.21 98.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 2.52 111.012 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -92.93 -32.42 14.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.144 0.497 . . . . 1.13 111.038 -177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -60.31 -39.5 87.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.615 -0.721 . . . . 2.52 111.305 178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.05 -44.02 98.35 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.473 -0.87 . . . . 0.46 111.727 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -67.67 -45.57 74.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.247 . . . . 2.04 111.422 178.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.32 -60.21 3.49 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.239 0.337 . . . . 1.07 111.469 -176.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.621 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 32.3 mt-10 -62.4 -36.14 81.4 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.823 -0.351 . . . . 1.96 110.973 -174.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -70.5 -41.84 72.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.278 -0.419 . . . . 2.74 110.974 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.3 p -69.68 -32.48 71.12 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.936 -0.306 . . . . 0.65 110.515 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 46.2 mm -59.51 -39.06 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.787 -0.449 . . . . 1.79 109.787 173.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.621 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 52.3 mt-10 -60.48 -43.07 97.35 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.343 -0.389 . . . . 2.82 110.47 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.2 mt -65.63 -46.06 90.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 1.2 111.05 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -31.59 71.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.225 0.535 . . . . 1.23 110.421 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.473 ' NH2' ' HG2' ' A' ' 90' ' ' GLU . 43.2 mtm180 -69.84 -35.98 75.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.871 -0.604 . . . . 5.02 110.457 174.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.3 98.22 Favored Glycine 0 N--CA 1.451 -0.325 0 O-C-N 123.325 0.391 . . . . 0.72 113.005 -176.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.9 mm -59.01 -49.07 84.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.202 0.525 . . . . 1.23 110.533 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.502 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 20.6 pttp -81.29 -7.71 59.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.866 -0.606 . . . . 3.16 111.232 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -77.34 -39.88 46.05 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.3 0.571 . . . . 1.33 109.983 174.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -86.92 10.03 17.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.613 -0.721 . . . . 3.64 109.645 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.697 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.4 m-85 -98.43 -40.23 8.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.574 -0.739 . . . . 1.28 110.017 162.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.601 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 18.9 m-85 -55.35 -38.99 69.49 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.168 0.509 . . . . 1.78 111.251 -178.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.7 p -70.66 -1.97 12.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.272 -0.876 . . . . 1.51 112.817 -173.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.7 2.31 75.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.626 -0.797 . . . . 1.16 111.345 -175.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -90.53 169.93 10.62 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.035 -0.728 . . . . 2.22 109.035 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.402 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.1 mt-10 -142.59 106.09 5.46 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.582 0.23 . . . . 1.75 110.751 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.566 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 23.0 Cg_endo -64.74 141.09 70.62 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.434 2.09 . . . . 0.71 111.304 174.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.4 t -72.56 161.26 31.02 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.055 -0.72 . . . . 2.17 109.055 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.503 ' HB3' ' HZ2' ' A' ' 107' ' ' LYS . 0.3 OUTLIER -62.2 -19.63 63.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.818 0.342 . . . . 3.31 111.145 -177.476 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.21 -40.92 86.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.254 -0.43 . . . . 2.24 110.185 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -58.27 -41.48 84.42 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.43 0.633 . . . . 1.73 110.243 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.49 -50.75 66.21 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.92 -1.036 . . . . 1.56 110.42 178.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -53.51 -52.82 58.38 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.404 -0.362 . . . . 2.31 110.951 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.72 86.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.912 -0.585 . . . . 1.19 111.321 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.6 m -66.74 -39.02 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.284 -0.416 . . . . 1.84 111.586 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 48.8 t -77.93 -37.54 23.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.551 0.691 . . . . 0.66 109.377 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 154' ' ' GLU . 22.2 ttmm -54.24 -39.83 67.15 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.792 -1.095 . . . . 2.26 110.727 173.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 4.6 tt0 -74.28 -32.4 62.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 116.569 -0.287 . . . . 2.27 110.385 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 99.3 t -59.21 -45.22 93.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.255 0.55 . . . . 0.91 110.358 172.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.25 -28.0 65.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.096 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.504 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 33.3 ttpt -61.21 -42.23 98.23 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.822 -0.807 . . . . 1.51 108.822 177.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.494 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.3 mp -71.87 -51.69 21.07 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.188 -0.915 . . . . 1.68 111.374 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.612 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 0.0 OUTLIER -69.89 -36.92 75.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 119.223 -0.991 . . . . 2.2 111.862 -167.243 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -64.6 -30.27 71.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.826 0.346 . . . . 2.44 111.146 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.15 -4.85 59.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.506 0.558 . . . . 1.16 112.506 -176.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.491 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 55.8 mtm -75.45 161.34 29.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.5 -0.48 . . . . 1.15 111.771 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.8 m -59.67 144.15 48.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.784 -0.644 . . . . 1.57 109.785 170.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.98 -40.79 94.79 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.555 0.217 . . . . 2.21 111.378 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.34 -29.6 70.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 1.18 110.636 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.28 -37.56 63.17 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.446 -0.662 . . . . 0.35 111.446 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.599 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 97.1 mttt -65.76 -46.89 77.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.261 0.553 . . . . 1.84 109.902 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.36 -35.56 81.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.414 -0.812 . . . . 1.15 111.472 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -76.04 -33.59 59.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.002 0.429 . . . . 0.55 110.006 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.705 -0.679 . . . . 0.49 110.146 172.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.502 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.56 -6.31 70.69 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 116.013 -0.54 . . . . 0.27 113.451 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -95.53 -50.55 4.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.226 0.536 . . . . 2.95 110.143 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -81.01 -20.92 40.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.2 -0.909 . . . . 1.83 111.168 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.668 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 12.4 m-85 -137.3 69.99 54.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.764 0.316 . . . . 0.91 111.102 174.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.17 -42.17 59.71 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.173 2.582 . . . . 1.06 113.067 -178.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 138' ' ' PHE . 30.7 t80 -61.87 -46.73 88.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.404 -0.362 . . . . 2.9 111.37 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.417 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 80.7 mt -72.45 -43.09 64.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.023 -0.271 . . . . 1.67 110.911 -177.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.502 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.86 -39.42 77.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.762 0.315 . . . . 1.04 110.225 177.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 38.9 ttpt -47.27 -66.49 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 3.06 111.115 173.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.404 ' HA ' ' HB3' ' A' ' 147' ' ' LYS . 3.3 m -64.78 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.515 -0.766 . . . . 0.5 112.824 -174.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.499 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 21.6 m-85 -76.14 -48.99 18.52 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.847 -0.741 . . . . 0.92 110.68 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -66.24 -38.7 88.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.4 -0.363 . . . . 2.58 111.151 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 13.5 m -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 1.81 111.806 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 83.62 12.46 77.84 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.692 -0.766 . . . . 1.41 112.574 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 142' ' ' VAL . 9.7 tppt? -61.5 -53.85 50.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 2.46 110.647 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.15 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 1.07 110.657 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.66 85.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.841 -0.618 . . . . 1.12 111.071 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 41.9 mmtm -69.95 -21.07 63.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.086 0.469 . . . . 3.27 110.629 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -91.71 -39.71 11.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.758 -0.656 . . . . 0.68 110.616 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -85.94 -4.07 59.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 1.18 112.278 -177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 70.13 27.43 72.94 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.926 -0.87 . . . . 1.62 110.926 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.423 ' O ' ' HG3' ' A' ' 115' ' ' LYS . 30.4 tt0 66.39 170.88 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.765 0.826 . . . . 4.12 110.832 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 30.2 t30 . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.512 -0.756 . . . . 4.01 109.611 176.198 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -14' ' ' MET . . . . . 0.491 ' SD ' ' HB3' ' A' ' 26' ' ' SER . 94.6 mmm . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 110.289 -0.263 . . . . 23.66 110.289 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 87.03 44.93 5.54 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 22.6 111.751 -178.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 10.0 m -80.12 78.23 6.79 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 122.135 0.174 . . . . 21.85 110.908 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 43.8 t 68.9 -60.99 0.43 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.536 0.735 . . . . 20.32 111.742 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 26.4 m170 -102.83 110.02 21.79 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.685 -0.487 . . . . 22.01 109.685 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -114.67 74.8 0.89 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.776 0.798 . . . . 18.73 110.717 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -134.45 -158.51 0.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.059 -0.973 . . . . 16.62 108.735 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -76.45 -38.22 55.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.014 -0.735 . . . . 13.55 109.014 173.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 55.9 27.17 10.67 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.829 -1.078 . . . . 12.8 112.405 166.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 57.84 77.61 0.27 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.132 -0.485 . . . . 11.87 110.868 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.9 m -57.21 135.82 56.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.169 -0.469 . . . . 7.99 110.256 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 18.8 m -90.49 35.26 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.368 -0.378 . . . . 7.5 111.427 -175.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 75.7 -78.01 1.22 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.129 -0.558 . . . . 4.74 112.302 178.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -129.39 134.77 48.03 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.852 -0.425 . . . . 5.19 109.852 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.448 ' HG3' ' OD1' ' A' ' 27' ' ' ASP . 95.8 mmm -130.88 143.69 50.92 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.682 -0.488 . . . . 2.17 109.682 179.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 11.4 p90 -75.71 149.73 38.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.985 0.421 . . . . 2.09 110.467 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -123.77 153.39 41.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.534 -0.543 . . . . 3.54 109.534 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.668 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 70.6 t80 -54.45 -45.32 73.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.281 0.562 . . . . 2.56 109.576 175.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -61.93 -27.7 69.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.148 -0.933 . . . . 4.16 112.064 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -79.44 -23.21 43.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.091 0.472 . . . . 2.57 110.329 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.44 133.71 84.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.184 -0.673 . . . . 1.31 109.184 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -44.25 110.46 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.14 2.56 . . . . 0.7 112.249 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.78 -21.84 66.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.493 -0.776 . . . . 1.23 112.209 -171.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.42 -35.42 80.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.332 0.587 . . . . 1.37 110.316 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.654 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 37.5 t80 -84.42 -29.4 26.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.09 -0.959 . . . . 1.08 110.956 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 11.9 mtm180 -65.95 -27.15 67.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.703 0.764 . . . . 2.1 109.059 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.41 -24.67 66.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.469 -1.241 . . . . 1.02 110.24 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.507 HD23 ' HG3' ' A' ' 147' ' ' LYS . 9.9 mt -97.55 1.78 49.33 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.639 -0.709 . . . . 1.49 110.191 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.603 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 96.0 mtp -96.47 137.37 21.54 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.153 -0.476 . . . . 1.65 110.071 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.06 142.03 95.94 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.626 2.217 . . . . 1.12 111.678 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.69 -19.07 51.58 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.464 2.776 . . . . 1.3 112.472 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.444 ' O ' HD12 ' A' ' 66' ' ' LEU . 4.0 mm-40 -62.57 -55.25 29.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.598 -0.728 . . . . 2.26 109.616 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.87 -28.6 65.78 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.482 -0.781 . . . . 1.39 111.01 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 35.5 mtp180 -67.12 -48.4 68.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 2.54 110.802 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 24.8 t70 -53.7 -46.82 70.86 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.515 0.198 . . . . 1.06 111.028 176.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.639 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 40.3 t80 -53.44 -60.3 3.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.985 -0.552 . . . . 0.73 111.049 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.504 HD23 ' CE1' ' A' ' 100' ' ' TYR . 83.8 mt -74.75 -4.66 38.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 119.31 0.959 . . . . 1.75 112.388 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 19' ' ' ARG . 37.8 mt-30 -71.92 -46.26 58.25 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 122.314 -0.241 . . . . 2.56 111.405 162.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.494 HD22 ' HA ' ' A' ' 21' ' ' PHE . 11.1 p30 -83.37 -26.88 30.09 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.525 0.565 . . . . 1.84 112.525 -175.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.663 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -63.13 134.9 56.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.841 -0.429 . . . . 1.7 109.841 166.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.491 ' HB3' ' SD ' ' A' ' -14' ' ' MET . 49.8 m -159.23 55.27 0.4 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.236 0.458 . . . . 2.16 112.236 -174.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.448 ' OD1' ' HG3' ' A' ' 0' ' ' MET . 20.0 t70 71.98 143.06 0.06 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.325 0.584 . . . . 2.39 111.238 176.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.02 -49.14 4.07 Favored Glycine 0 N--CA 1.451 -0.32 0 N-CA-C 110.776 -0.93 . . . . 1.47 110.776 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -78.72 -49.43 13.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.112 -0.544 . . . . 2.25 110.28 173.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.422 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 89.2 mttt -55.32 -26.45 40.73 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.377 0.608 . . . . 1.89 110.703 174.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.459 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 14.9 m -64.69 -32.87 74.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.212 -0.903 . . . . 1.37 111.102 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 7.8 p -90.62 -23.61 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.23 -0.441 . . . . 0.85 110.512 -178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.451 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.2 mm? -54.59 -49.03 71.39 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.49 -0.323 . . . . 1.65 110.895 171.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 20.9 ptmt -65.43 -27.67 68.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.424 -0.353 . . . . 2.89 111.407 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -67.26 -37.33 83.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 1.96 110.157 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.4 t -73.54 -53.97 16.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.252 0.549 . . . . 0.98 110.468 177.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.601 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 27.5 m-85 -53.93 -45.11 71.14 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.345 1.239 . . . . 1.08 114.345 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -79.08 -1.4 35.64 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 119.988 -0.685 . . . . 2.71 111.16 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -99.82 17.08 21.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.394 0.616 . . . . 1.57 109.668 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -88.06 -160.61 36.01 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.444 -0.798 . . . . 1.54 111.62 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.78 160.8 95.45 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 123.334 -1.527 . . . . 1.99 112.256 -1.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -112.52 127.29 56.02 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.136 0.493 . . . . 1.72 110.252 177.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -65.65 -21.98 66.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.862 -1.063 . . . . 4.11 110.996 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.77 141.48 20.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.735 -0.666 . . . . 1.53 110.093 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.4 m -57.72 -28.31 63.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.242 -0.89 . . . . 1.72 112.215 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.64 -34.93 69.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.256 -0.429 . . . . 2.24 111.695 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.24 -34.22 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.689 0.255 . . . . 2.26 111.689 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m -64.57 -41.02 96.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.309 0.576 . . . . 1.69 109.821 176.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.9 mt -67.19 -43.14 88.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.392 -0.822 . . . . 1.2 110.561 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.46 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -58.11 -47.25 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.364 -0.835 . . . . 1.29 110.824 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.38 -37.46 77.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.084 -0.507 . . . . 1.21 110.481 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.417 HD22 HD11 ' A' ' 33' ' ' LEU . 21.3 mt -69.74 -40.32 76.26 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.529 -0.759 . . . . 1.13 110.891 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -66.56 -23.5 66.22 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.848 0.356 . . . . 1.87 111.776 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -80.41 -26.59 38.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.097 0.475 . . . . 3.57 110.622 176.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -91.95 -58.91 2.25 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.977 -0.556 . . . . 2.01 111.058 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.5 t -131.02 104.15 15.36 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-O 121.294 0.569 . . . . 1.68 109.493 -175.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.08 -52.9 7.48 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 123.645 2.897 . . . . 0.84 112.129 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -61.31 -41.38 96.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.612 -1.176 . . . . 2.45 112.196 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.7 -40.01 73.11 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 119.443 -0.903 . . . . 2.03 109.639 -173.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.591 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.69 -36.6 93.51 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 114.614 -1.175 . . . . 0.41 111.61 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.82 94.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.719 0.295 . . . . 1.19 110.652 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -56.99 -59.66 4.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.926 -0.579 . . . . 2.7 110.911 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.97 -32.91 59.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.421 . . . . 1.12 111.744 -177.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.591 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -62.52 -55.61 25.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 1.7 110.484 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.473 ' HZ1' ' HB3' ' A' ' 65' ' ' LYS . 9.0 mtpm? -67.42 -33.09 74.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.548 0.69 . . . . 4.35 110.104 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.495 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 15.2 tp -66.52 -50.38 63.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.959 -1.019 . . . . 2.09 111.83 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.505 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.9 OUTLIER -74.57 -21.73 59.35 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.185 -0.672 . . . . 3.07 109.185 -174.433 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.49 99.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.905 -1.043 . . . . 1.26 110.648 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.495 ' HE1' ' HA ' ' A' ' 66' ' ' LEU . 28.4 mtm -63.45 -44.3 94.9 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.483 -0.562 . . . . 1.21 109.483 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.42 -49.21 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 114.996 -1.002 . . . . 0.79 110.299 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -62.45 -36.69 83.23 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 115.554 -0.748 . . . . 2.03 111.517 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -63.79 -41.12 98.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.92 0.39 . . . . 1.66 111.211 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 60.2 mttp -67.96 -44.88 75.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.213 -0.449 . . . . 2.14 110.039 177.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 79.1 mt -68.48 -22.57 27.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.456 0.646 . . . . 1.1 110.614 177.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.14 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.791 0.805 . . . . 1.18 109.744 177.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.46 -2.04 56.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.421 -1.263 . . . . 1.11 110.397 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.9 tp -93.82 134.77 35.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.403 -0.817 . . . . 1.34 110.114 -174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.39 155.41 40.18 Favored Glycine 0 C--O 1.225 -0.445 0 CA-C-O 119.669 -0.517 . . . . 0.76 112.619 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -43.19 -43.21 10.06 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 124.072 3.182 . . . . 1.89 114.49 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -66.22 -54.13 28.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.719 0.295 . . . . 2.52 110.265 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.67 -32.0 63.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.462 -0.495 . . . . 1.13 110.59 -174.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -61.53 -51.94 66.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 2.52 111.341 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.04 -34.62 89.55 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.356 -0.926 . . . . 0.46 111.214 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.86 -49.1 64.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.029 -0.585 . . . . 2.04 112.252 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.44 63.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.762 -0.654 . . . . 1.07 111.753 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.75 -20.5 63.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.899 -0.591 . . . . 1.96 111.142 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 14.4 tppt? -90.22 -42.28 11.11 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.079 0.466 . . . . 2.74 111.074 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -71.43 -43.78 66.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.99 0.424 . . . . 0.65 110.998 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.469 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 77.9 mt -67.85 -30.37 48.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 1.79 111.935 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 10.6 pt-20 -67.15 -28.73 68.37 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.15 -0.62 . . . . 2.82 109.981 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.1 mt -67.29 -45.15 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 109.401 -0.592 . . . . 1.2 109.401 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.25 -39.16 91.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.79 -0.641 . . . . 1.23 110.604 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 19.1 mtm180 -68.41 -28.75 67.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.645 -0.707 . . . . 5.02 110.617 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -73.78 -31.67 60.03 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.266 -0.492 . . . . 0.72 112.351 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.16 -50.63 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.034 0.445 . . . . 1.23 110.274 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -79.28 -7.71 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 3.16 110.942 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.43 -33.76 71.7 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.425 -0.583 . . . . 1.33 109.425 168.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.622 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 78.6 mtp180 -85.44 -3.94 59.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.805 -0.634 . . . . 3.64 110.0 175.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -88.25 -32.21 18.64 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.988 -0.685 . . . . 1.28 109.457 166.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.655 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 35.2 m-85 -69.6 -54.66 12.95 Favored 'General case' 0 N--CA 1.46 0.047 0 CA-C-O 121.022 0.439 . . . . 1.78 110.631 176.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 p -61.21 -26.92 68.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.273 0.842 . . . . 1.51 113.273 -172.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 103.47 -10.7 53.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.62 -0.8 . . . . 1.16 112.141 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.622 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 91.5 m-20 -85.07 57.95 4.74 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.302 -0.258 . . . . 2.22 110.302 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.93 125.61 18.26 Favored Pre-proline 0 N--CA 1.464 0.251 0 N-CA-C 112.797 0.666 . . . . 1.75 112.797 -172.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.33 142.75 30.56 Favored 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.811 2.341 . . . . 0.71 111.324 175.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -78.18 169.47 18.21 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.493 -0.558 . . . . 2.17 109.493 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.515 ' HZ3' ' HB2' ' A' ' 107' ' ' LYS . 4.3 ttmp? -61.33 -34.59 75.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 118.26 0.482 . . . . 3.31 110.648 -174.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -65.35 -30.21 71.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.798 -0.637 . . . . 2.24 110.982 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -63.56 -40.21 96.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.246 0.546 . . . . 1.73 110.235 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.518 ' HA ' ' OG ' ' A' ' 113' ' ' SER . 11.0 mp -71.39 -42.42 68.41 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.515 -0.766 . . . . 1.56 110.652 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -55.76 -42.73 75.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.094 0.473 . . . . 2.31 110.068 176.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.531 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -67.51 -39.08 85.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.854 -0.612 . . . . 1.19 112.337 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.518 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 3.9 p -74.29 -33.31 63.21 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.436 0.532 . . . . 1.84 112.436 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.0 m -74.3 -27.41 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 107.83 -1.174 . . . . 0.66 107.83 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.599 ' HG3' ' OE1' ' A' ' 154' ' ' GLU . 23.0 ttmm -64.24 -35.42 80.78 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.882 -1.508 . . . . 2.26 110.775 177.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 119' ' ' LYS . 28.5 mt-10 -77.02 -40.05 47.98 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.112 -0.635 . . . . 2.27 111.076 178.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.5 m -66.79 -24.62 32.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.359 -0.536 . . . . 0.91 110.229 178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 30.3 mt -84.19 -37.83 21.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.387 -0.37 . . . . 1.75 111.117 171.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.438 ' HB3' ' HA ' ' A' ' 116' ' ' GLU . 36.5 ttpt -55.86 -44.12 77.77 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.297 -1.001 . . . . 1.51 108.297 176.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.409 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.4 mp -69.25 -54.47 14.56 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 113.947 -1.478 . . . . 1.68 111.867 174.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.642 ' HE1' ' CE2' ' A' ' 121' ' ' TYR . 61.4 t80 -69.37 -31.31 69.63 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 119.684 -0.806 . . . . 2.2 111.803 -167.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -66.33 -28.44 68.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.848 0.356 . . . . 2.44 110.976 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.83 -3.36 58.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.167 0.803 . . . . 1.16 113.167 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.0 mtm -77.4 158.18 30.2 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.851 -0.74 . . . . 1.15 110.663 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 34.6 t -66.18 149.73 49.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.796 -0.446 . . . . 1.57 109.796 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -53.11 -43.75 67.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.603 0.24 . . . . 2.21 111.266 -176.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -70.02 -34.91 73.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 1.18 110.973 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.5 -45.14 80.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.952 -0.567 . . . . 0.35 112.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -74.73 -24.97 58.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.328 . . . . 1.84 110.485 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.86 -45.28 94.48 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.538 0.685 . . . . 1.15 110.509 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.15 -28.93 63.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.859 -1.064 . . . . 0.55 109.679 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 1.649 ' HE1' ' CE2' ' A' ' 132' ' ' PHE . 32.0 t80 -62.19 -30.05 70.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.324 -0.853 . . . . 0.49 109.295 171.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.09 -7.24 88.58 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.664 -0.698 . . . . 0.27 112.936 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -88.98 -40.98 12.64 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-O 121.342 0.591 . . . . 2.95 110.155 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.445 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 8.6 mm100 -85.98 -30.34 22.82 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.091 -0.959 . . . . 1.83 110.57 -177.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.669 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 58.4 m-85 -132.96 70.86 78.53 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.057 0.456 . . . . 0.91 110.635 173.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.24 -27.28 72.21 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.953 2.435 . . . . 1.06 112.088 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.651 ' HE2' ' CE1' ' A' ' 138' ' ' PHE . 25.8 t80 -66.34 -39.49 89.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.799 -0.637 . . . . 2.9 110.399 -178.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.3 -42.11 17.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.105 -0.498 . . . . 1.67 110.793 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.81 -34.31 71.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.475 -0.565 . . . . 1.04 109.475 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 28.6 tptp -50.5 -75.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.163 -0.926 . . . . 3.06 111.633 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.5 m -63.68 -27.64 43.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.794 -0.639 . . . . 0.5 112.616 -172.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.79 -44.94 69.05 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.382 -0.527 . . . . 0.92 110.446 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -83.17 -27.27 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.401 -0.363 . . . . 2.58 111.265 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 9.7 t -71.51 -19.59 62.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.927 0.394 . . . . 1.81 110.67 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.404 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 102.74 -10.35 55.85 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.619 -0.801 . . . . 1.41 112.583 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.507 ' HG3' HD23 ' A' ' 13' ' ' LEU . 46.2 tptt -54.55 -48.15 72.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.854 0.359 . . . . 2.46 110.79 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -75.36 -44.77 43.27 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.24 -0.436 . . . . 1.07 110.922 178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -56.13 -40.07 73.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.696 -0.684 . . . . 1.12 112.611 -175.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.404 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 4.8 mptp? -83.41 -16.55 45.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 3.27 110.901 -177.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -78.81 -35.13 44.64 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.45 -0.574 . . . . 0.68 109.45 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -77.58 -27.25 51.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.754 -0.657 . . . . 1.18 110.955 176.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 61.4 75.76 0.28 Allowed Glycine 0 C--O 1.237 0.289 0 C-N-CA 120.945 -0.645 . . . . 1.62 111.958 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.599 ' OE1' ' HG3' ' A' ' 115' ' ' LYS . 8.6 pt-20 -159.05 9.46 0.13 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.715 0.635 . . . . 4.12 112.715 -175.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.563 HD21 ' HG3' ' A' ' 154' ' ' GLU . 10.2 p30 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.494 -0.765 . . . . 4.01 109.548 -175.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 120.785 0.326 . . . . 23.66 110.553 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -94.48 -35.18 6.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.634 -0.794 . . . . 22.6 112.663 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 26.1 t -80.68 105.31 11.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.049 0.452 . . . . 21.85 110.22 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 4.0 p -79.41 58.97 2.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.356 0.598 . . . . 20.32 111.493 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 56.9 m80 -117.21 1.9 12.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.445 0.64 . . . . 22.01 109.38 173.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -159.16 129.06 5.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.164 -0.925 . . . . 18.73 109.727 -177.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -105.11 103.36 12.89 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.667 -0.494 . . . . 16.62 109.667 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -73.12 137.94 45.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.229 -0.441 . . . . 13.55 110.503 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -80.88 95.13 6.63 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.428 -0.582 . . . . 12.8 109.428 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -65.36 -18.45 65.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.622 -0.717 . . . . 11.87 110.712 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 2.5 m -66.73 -19.11 65.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.791 -0.64 . . . . 7.99 110.927 177.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 39.8 m -89.99 -5.74 56.35 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.258 -0.428 . . . . 7.5 110.892 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -66.47 -62.05 4.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 4.74 111.565 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -90.73 102.53 15.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.361 -0.607 . . . . 5.19 109.361 175.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 28.1 ttm -102.4 109.81 21.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.37 -0.377 . . . . 2.17 110.718 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.664 ' HE1' ' CE2' ' A' ' 1' ' ' PHE . 55.2 t80 -44.41 129.95 6.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.285 -0.87 . . . . 2.09 112.179 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -123.12 114.91 20.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.647 -0.706 . . . . 3.54 109.21 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.646 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 59.5 t80 -68.35 -24.07 64.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.314 0.578 . . . . 2.56 110.204 -178.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -86.1 -2.73 58.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.59 -0.732 . . . . 4.16 110.394 178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -94.08 -10.76 32.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.549 0.69 . . . . 2.57 109.529 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.0 mt -80.74 131.6 60.16 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.345 -0.843 . . . . 1.31 109.021 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -37.81 115.36 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.745 2.964 . . . . 0.7 112.679 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.17 -17.78 64.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 1.23 111.551 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -74.67 -26.58 59.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.92 0.867 . . . . 1.37 109.299 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.648 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 65.4 t80 -85.13 -31.42 23.31 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.228 -1.351 . . . . 1.08 110.656 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -67.88 -18.55 64.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.301 0.572 . . . . 2.1 110.028 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.71 -21.64 64.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.185 -0.916 . . . . 1.02 110.748 175.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.489 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 90.7 mt -87.4 -6.99 58.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.069 -0.514 . . . . 1.49 110.916 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 63.6 mtt -86.75 126.98 61.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.341 -0.391 . . . . 1.65 110.63 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -75.35 155.39 41.31 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.36 2.04 . . . . 1.12 111.572 175.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.17 -49.37 7.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.577 2.851 . . . . 1.3 113.492 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -51.36 -51.42 54.7 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.831 0.348 . . . . 2.26 111.605 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.34 -28.18 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.809 0.337 . . . . 1.39 111.405 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -76.55 -39.01 54.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.359 -0.382 . . . . 2.54 110.465 178.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -46.71 -55.38 7.87 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.934 0.771 . . . . 1.06 110.976 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.652 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 40.8 t80 -56.43 -63.39 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.673 -0.694 . . . . 0.73 112.366 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -75.1 -5.36 43.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 119.223 0.92 . . . . 1.75 111.72 -174.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -74.41 -37.49 63.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.008 0.432 . . . . 2.56 110.377 162.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.37 -48.09 74.14 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.786 -0.643 . . . . 1.84 111.717 -177.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.59 137.09 56.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.195 0.522 . . . . 1.7 110.578 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -131.58 -64.22 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.683 -0.689 . . . . 2.16 111.93 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 2.7 p-10 -135.76 -90.49 0.3 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.599 0.592 . . . . 2.39 112.599 -173.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.438 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -62.54 -19.73 60.58 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 114.153 0.421 . . . . 1.47 114.153 -171.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -76.82 -34.82 57.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.983 0.391 . . . . 2.25 110.93 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.442 ' HD3' ' O ' ' A' ' 1' ' ' PHE . 95.7 mttt -65.67 -27.38 68.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.524 0.678 . . . . 1.89 110.487 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 66.0 m -60.71 -38.18 84.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.917 -1.038 . . . . 1.37 111.246 176.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 6.2 p -89.91 -21.87 6.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.982 -0.554 . . . . 0.85 111.581 -173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.466 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 3.1 mm? -50.41 -50.91 50.46 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.804 0.298 . . . . 1.65 111.804 172.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 9.2 ptpp? -65.72 -25.02 67.11 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.809 0.338 . . . . 2.89 111.395 -176.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.55 -31.58 68.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.224 0.535 . . . . 1.96 109.891 176.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 89.7 t -74.71 -51.19 23.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.489 -0.778 . . . . 0.98 110.19 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -53.69 -42.79 68.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.233 0.827 . . . . 1.08 113.233 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.41 21.55 2.85 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.876 -0.73 . . . . 2.71 111.023 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -122.11 12.38 10.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.827 -0.624 . . . . 1.57 110.081 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.03 -156.82 10.41 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.71 -0.677 . . . . 1.54 112.19 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.69 165.12 84.61 Favored 'Cis proline' 0 C--N 1.343 0.281 0 C-N-CA 123.809 -1.33 . . . . 1.99 112.981 0.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.441 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 54.7 m-85 -123.12 124.81 43.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.604 -0.725 . . . . 1.72 110.379 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -79.68 -20.53 46.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.211 -0.904 . . . . 4.11 110.575 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.497 HD22 ' HG3' ' A' ' 47' ' ' GLU . 5.4 p30 -144.75 174.27 11.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.142 -0.481 . . . . 1.53 110.889 -171.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.1 m -72.06 -39.5 69.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.482 -0.326 . . . . 1.72 111.091 -178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -59.05 -42.29 89.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.101 -0.499 . . . . 2.24 111.751 -172.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' HG3' HD22 ' A' ' 44' ' ' ASN . 46.7 mt-10 -54.96 -39.57 69.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.802 0.334 . . . . 2.26 111.485 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.7 m -72.71 -42.09 64.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.245 -0.434 . . . . 1.69 110.442 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 60.7 mt -65.46 -38.33 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 1.2 110.281 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.58 -52.51 64.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.375 -0.829 . . . . 1.29 111.186 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.74 77.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.752 -0.658 . . . . 1.21 110.328 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 59' ' ' LEU . 37.1 mt -70.3 -40.66 74.11 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.12 -0.946 . . . . 1.13 111.41 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -66.52 -23.49 66.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.064 0.459 . . . . 1.87 111.26 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.472 ' HB2' ' HZ2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -78.33 -50.98 10.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 3.57 109.92 175.438 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -67.35 -62.21 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.784 -0.643 . . . . 2.01 111.909 179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -132.33 90.8 33.14 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 116.043 -0.526 . . . . 1.68 109.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -41.55 -57.51 1.43 Allowed 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.829 3.019 . . . . 0.84 113.685 -171.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 30.5 tt0 -62.69 -27.03 68.97 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.234 -0.894 . . . . 2.45 111.982 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 2.2 tt -70.79 -46.25 63.2 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.786 -1.19 . . . . 2.03 107.786 -178.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.98 -32.07 83.02 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 114.407 -1.269 . . . . 0.41 111.318 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.43 91.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.666 0.269 . . . . 1.19 110.457 174.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 61.7 mttp -54.54 -53.4 54.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.995 -0.548 . . . . 2.7 110.125 175.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.8 t -65.25 -41.61 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.708 -0.678 . . . . 1.12 111.02 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.39 -55.19 37.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.785 -0.643 . . . . 1.7 110.698 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.567 ' O ' ' HG3' ' A' ' 69' ' ' MET . 8.6 mtpm? -63.48 -41.14 98.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.343 0.592 . . . . 4.35 110.304 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.514 HD23 ' HB2' ' A' ' 21' ' ' PHE . 16.4 tp -62.97 -50.59 70.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.331 -0.85 . . . . 2.09 112.298 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -77.23 -17.23 58.62 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.881 -0.785 . . . . 3.07 108.881 -172.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.0 81.12 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.625 -0.716 . . . . 1.26 109.879 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 21.5 mtm -67.86 -46.85 70.56 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.281 -0.637 . . . . 1.21 109.281 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.3 m -62.13 -35.27 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.625 -0.716 . . . . 0.79 109.832 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -65.42 -41.99 92.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.004 -0.544 . . . . 2.03 110.663 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 m -59.71 -29.72 68.3 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.197 0.523 . . . . 1.66 110.459 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.584 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 87.7 mttt -82.11 -47.01 13.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.557 -0.747 . . . . 2.14 110.837 177.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.9 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 1.1 111.418 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.03 -31.12 71.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.475 0.655 . . . . 1.18 110.274 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.47 58.69 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.836 -1.074 . . . . 1.11 110.669 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.568 ' CD2' ' HA ' ' A' ' 132' ' ' PHE . 97.4 mt -43.59 140.39 1.8 Allowed 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 112.74 0.644 . . . . 1.34 112.74 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 159.6 39.23 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.592 -1.003 . . . . 0.76 110.592 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -43.5 -35.82 6.32 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.561 2.841 . . . . 1.89 113.522 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.0 -48.35 37.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.523 -0.308 . . . . 2.52 111.15 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.428 ' HB1' ' HB3' ' A' ' 77' ' ' LEU . . . -72.41 -34.87 68.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.333 0.587 . . . . 1.13 110.146 -174.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -58.38 -44.66 88.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.878 -1.055 . . . . 2.52 110.741 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.66 -43.97 97.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.167 -0.539 . . . . 0.46 112.54 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -66.87 -44.09 81.83 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.529 0.204 . . . . 2.04 110.951 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.69 -46.64 81.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.131 0.491 . . . . 1.07 111.28 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 45.5 mt-10 -66.32 -42.43 88.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.66 -0.7 . . . . 1.96 110.529 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.09 -46.94 69.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.396 -0.366 . . . . 2.74 111.134 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -60.39 -39.88 88.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.762 0.315 . . . . 0.65 110.757 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.1 mt -65.5 -39.69 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 116.392 -0.367 . . . . 1.79 110.818 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.582 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 54.4 mt-10 -56.62 -48.21 77.97 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.069 0.461 . . . . 2.82 110.361 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.5 mt -64.59 -44.23 96.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.471 -0.786 . . . . 1.2 110.892 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.6 66.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.05 0.452 . . . . 1.23 110.941 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -62.89 -38.72 92.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.987 -0.551 . . . . 5.02 110.78 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -71.74 -39.31 60.2 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.06 -0.591 . . . . 0.72 113.065 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.41 -54.1 38.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.854 0.359 . . . . 1.23 110.779 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.548 ' HB2' ' HZ2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -87.17 29.94 0.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 3.16 110.07 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -112.83 -34.85 5.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.994 -1.003 . . . . 1.33 108.755 164.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -80.9 -13.38 58.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 3.64 109.798 177.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -77.38 -34.05 55.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.463 -0.569 . . . . 1.28 109.463 167.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.67 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 1.2 m-85 -77.83 -35.92 50.65 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.956 0.724 . . . . 1.78 112.956 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -65.04 -9.63 23.54 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.586 0.587 . . . . 1.51 112.586 -174.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.89 14.68 22.42 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.754 -0.736 . . . . 1.16 111.531 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -117.88 -177.73 3.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.932 -0.396 . . . . 2.22 109.932 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.429 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.4 mt-10 -142.52 105.19 5.45 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.318 -0.401 . . . . 1.75 110.729 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.1 Cg_endo -58.1 143.85 95.94 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.835 1.69 . . . . 0.71 110.133 170.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.6 p -76.04 170.21 16.71 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.851 -0.426 . . . . 2.17 109.851 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.4 tptm -64.16 -30.37 71.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.136 -0.69 . . . . 3.31 109.136 178.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -69.86 -30.11 67.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.373 -0.831 . . . . 2.24 110.81 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -60.57 -46.28 90.81 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.801 -0.444 . . . . 1.73 109.801 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.5 mp -65.77 -44.94 84.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.529 -0.76 . . . . 1.56 110.918 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 57.6 mtpt -59.41 -39.97 85.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.173 0.511 . . . . 2.31 110.445 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.425 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -69.4 -42.89 74.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.727 -0.669 . . . . 1.19 111.413 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.2 p -61.79 -38.16 87.02 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.072 -0.251 . . . . 1.84 111.558 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.501 ' O ' HD21 ' A' ' 118' ' ' LEU . 7.8 m -80.76 -25.83 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.395 0.617 . . . . 0.66 109.447 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.425 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 41.1 ttmt -55.95 -44.56 78.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.701 -0.681 . . . . 2.26 110.994 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.487 ' O ' HD11 ' A' ' 120' ' ' LEU . 24.0 mt-10 -72.71 -34.21 66.98 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.271 -0.572 . . . . 2.27 111.006 -176.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -66.16 -34.03 67.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.144 -0.622 . . . . 0.91 110.505 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.501 HD21 ' O ' ' A' ' 114' ' ' VAL . 4.1 mm? -73.19 -33.78 65.59 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.923 -0.486 . . . . 1.75 110.313 172.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.01 -45.64 90.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.996 -0.742 . . . . 1.51 108.996 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.487 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -72.27 -49.9 31.29 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.663 -1.153 . . . . 1.68 111.53 176.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -69.79 -37.47 76.33 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 119.849 -0.741 . . . . 2.2 111.747 -168.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.466 ' HE3' HD13 ' A' ' 118' ' ' LEU . 93.0 mttt -64.46 -29.88 70.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.931 0.396 . . . . 2.44 110.896 178.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.17 -6.68 59.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 1.16 112.397 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.2 mtm -76.72 157.08 31.99 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.119 -0.633 . . . . 1.15 110.313 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 70.5 m -70.06 153.39 43.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 121.06 -0.256 . . . . 1.57 110.705 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -54.97 -46.07 75.04 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.168 0.433 . . . . 2.21 112.168 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.7 75.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.775 0.322 . . . . 1.18 111.076 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -68.14 -38.11 87.72 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.016 -0.538 . . . . 0.35 112.143 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.73 -46.39 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.323 0.582 . . . . 1.84 110.154 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.05 -34.41 77.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.134 -0.939 . . . . 1.15 111.443 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -74.18 -31.66 62.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.683 -0.488 . . . . 0.55 109.683 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.568 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . 89.7 t80 -64.07 -34.45 78.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.777 -0.647 . . . . 0.49 110.674 175.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.21 -4.91 57.79 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.133 -0.556 . . . . 0.27 113.475 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -91.59 -23.14 19.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.567 0.699 . . . . 2.95 110.088 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.584 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -108.81 -35.82 6.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.052 -0.976 . . . . 1.83 110.889 -173.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.653 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 44.5 m-85 -128.77 71.61 81.24 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.256 -0.646 . . . . 0.91 109.256 171.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.88 -33.88 62.53 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.016 2.478 . . . . 1.06 112.75 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.65 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 28.6 m-85 -65.98 -30.55 71.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.448 -0.342 . . . . 2.9 111.492 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.9 mp -77.48 -48.23 17.63 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.399 -0.52 . . . . 1.67 110.028 177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.16 -31.55 65.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.545 0.688 . . . . 1.04 109.854 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 56.2 tttp -58.41 -75.09 0.05 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.804 -1.089 . . . . 3.06 111.43 171.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.5 -26.68 40.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 112.895 0.702 . . . . 0.5 112.895 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -71.63 -47.89 51.52 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.682 -0.407 . . . . 0.92 110.478 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.24 -23.91 47.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 2.58 111.188 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.7 t -70.71 -19.29 62.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.254 0.55 . . . . 1.81 109.775 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 96.86 -9.62 66.01 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.973 -0.632 . . . . 1.41 112.582 177.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.489 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 8.8 tmtm? -57.14 -50.7 71.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 2.46 110.408 -176.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.5 83.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 1.07 111.092 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.97 80.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.126 -0.488 . . . . 1.12 111.812 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 14.4 mmmm -75.36 -35.42 61.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.88 0.371 . . . . 3.27 110.352 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.667 ' HD2' ' CD1' ' A' ' 151' ' ' PHE . 22.2 t80 -61.77 -40.57 95.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.68 109.705 173.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.88 -42.37 94.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.602 -0.727 . . . . 1.18 111.133 177.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 64.84 50.01 60.49 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.731 -0.747 . . . . 1.62 111.587 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.45 17.73 8.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.992 0.425 . . . . 4.12 110.983 -176.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-N 116.047 -0.524 . . . . 4.01 110.215 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 120.855 0.36 . . . . 23.66 110.44 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 172.41 161.75 23.41 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 111.391 -0.684 . . . . 22.6 111.391 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 21.9 m -81.08 59.03 3.69 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 21.85 111.082 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 9.4 t -102.84 60.88 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.334 0.588 . . . . 20.32 109.626 178.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -129.45 102.5 6.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.701 . . . . 22.01 109.454 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.19 124.91 19.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 18.73 111.267 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -147.39 55.3 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.613 0.72 . . . . 16.62 110.045 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -62.1 111.66 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.158 -0.928 . . . . 13.55 110.199 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 30.7 m-70 -58.94 111.45 1.31 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.837 -0.619 . . . . 12.8 111.386 -177.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -136.71 30.06 2.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.512 -0.767 . . . . 11.87 109.151 177.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' SER . . . . . 0.435 ' HB2' ' SD ' ' A' ' 0' ' ' MET . 6.2 p -133.76 79.41 1.82 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.154 -0.93 . . . . 7.99 111.263 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 40.0 m -140.99 41.47 1.81 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.288 0.566 . . . . 7.5 110.077 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -131.76 -50.0 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.65 -0.785 . . . . 4.74 112.275 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -132.61 50.42 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.614 0.245 . . . . 5.19 111.043 -177.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.435 ' SD ' ' HB2' ' A' ' -4' ' ' SER . 89.1 mmm -101.39 128.8 47.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.875 0.369 . . . . 2.17 110.06 177.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.647 ' HD1' ' CD2' ' A' ' 1' ' ' PHE . 9.0 p90 -75.91 138.85 41.3 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.525 0.678 . . . . 2.09 110.906 -178.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -107.88 138.11 44.71 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.71 -0.677 . . . . 3.54 109.584 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.66 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 22.5 t80 -70.72 -17.26 62.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.433 0.635 . . . . 2.56 109.619 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -92.74 2.35 56.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.31 -0.859 . . . . 4.16 110.127 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -106.38 -16.15 14.63 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.045 -0.525 . . . . 2.57 110.134 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.6 mt -76.6 133.9 70.06 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 108.319 -0.993 . . . . 1.31 108.319 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -43.06 116.2 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.298 2.665 . . . . 0.7 112.875 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.74 -22.56 67.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.983 -0.553 . . . . 1.23 111.491 -175.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.24 -34.45 78.04 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.129 0.966 . . . . 1.37 108.925 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 64.5 t80 -85.37 -24.57 27.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.673 -1.603 . . . . 1.08 110.49 -176.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -71.78 -20.46 61.86 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.401 0.62 . . . . 2.1 109.467 177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.61 -19.08 62.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.932 -1.031 . . . . 1.02 110.371 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.8 mt -96.39 12.98 29.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.593 -0.731 . . . . 1.49 110.304 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 59.8 mtt -100.42 128.75 29.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.217 -0.447 . . . . 1.65 110.604 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -62.68 137.35 63.24 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.379 2.053 . . . . 1.12 110.746 175.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -50.49 -29.58 24.93 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.779 2.986 . . . . 1.3 113.656 -175.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.506 ' O ' HD12 ' A' ' 66' ' ' LEU . 20.2 mp0 -64.54 -50.19 68.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.072 0.463 . . . . 2.26 110.236 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.18 -29.59 69.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.554 . . . . 1.39 110.796 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -68.55 -45.56 71.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.524 . . . . 2.54 110.389 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.43 -41.13 65.74 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.45 0.469 . . . . 1.06 111.436 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.628 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 34.2 t80 -60.59 -68.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.849 -0.614 . . . . 0.73 111.222 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.537 HD22 ' CE1' ' A' ' 100' ' ' TYR . 69.4 mt -70.01 -6.97 37.12 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 119.2 0.909 . . . . 1.75 112.069 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.81 -53.19 50.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.518 0.199 . . . . 2.56 110.801 163.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -81.0 -31.65 34.59 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.483 0.549 . . . . 1.84 112.483 -173.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.535 HD21 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -56.41 131.12 47.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.711 0.767 . . . . 1.7 111.023 173.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.1 m -124.37 178.61 5.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.593 -1.185 . . . . 2.16 109.374 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.77 -47.29 64.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.798 0.333 . . . . 2.39 111.644 -175.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.59 -48.75 79.3 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.959 -0.639 . . . . 1.47 112.538 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -65.89 -43.96 86.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.708 0.29 . . . . 2.25 110.999 -178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.07 -17.58 57.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.438 -0.346 . . . . 1.89 111.534 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.3 m -64.77 -43.64 92.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.454 0.645 . . . . 1.37 109.888 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.45 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 2.8 p -79.21 -29.69 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 CA-C-N 115.262 -0.881 . . . . 0.85 110.082 -176.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD11 HD22 ' A' ' 52' ' ' LEU . 4.2 mm? -54.88 -42.41 72.04 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 121.044 0.45 . . . . 1.65 110.167 169.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.476 ' HA ' ' CG2' ' A' ' 101' ' ' THR . 63.3 tttp -62.99 -29.64 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 2.89 111.019 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -77.99 -24.98 47.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.96 110.81 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.0 t -80.9 -57.2 5.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.717 0.77 . . . . 0.98 110.009 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.668 ' HD1' ' CD2' ' A' ' 37' ' ' PHE . 17.8 m-85 -54.52 -42.55 70.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.652 -1.158 . . . . 1.08 114.116 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.629 ' HE3' ' OG1' ' A' ' 101' ' ' THR . 5.1 mmpt? -86.1 8.27 21.48 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.966 -0.694 . . . . 2.71 111.346 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -102.8 -77.98 0.55 Allowed 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.512 -0.767 . . . . 1.57 108.975 169.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.432 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 44.56 -151.79 0.65 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.99 -0.624 . . . . 1.54 112.947 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -91.0 145.27 15.05 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 118.716 1.258 . . . . 1.99 111.421 -8.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.432 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 22.7 m-85 -112.18 120.42 41.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.472 0.653 . . . . 1.72 111.35 -173.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -81.13 -19.2 44.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.822 -1.081 . . . . 4.11 110.649 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.402 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -146.09 160.03 42.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.955 -0.566 . . . . 1.53 109.548 -174.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.0 m -66.29 -30.57 71.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.231 -0.441 . . . . 1.72 111.947 -174.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.402 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 41.0 tt0 -59.58 -39.45 84.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.968 -0.105 . . . . 2.24 111.234 -177.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.55 -46.38 90.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.615 -0.266 . . . . 2.26 111.311 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -65.76 -34.32 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 1.69 110.919 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 88.6 mt -67.2 -41.79 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 1.2 110.21 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -57.4 -51.76 68.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 1.29 111.249 177.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.29 -42.56 77.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 1.21 110.511 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.405 HD22 HD11 ' A' ' 33' ' ' LEU . 18.7 mt -66.64 -39.09 88.11 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.341 -0.845 . . . . 1.13 111.169 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -63.92 -31.02 72.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.87 111.03 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -73.99 -46.22 45.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.257 0.551 . . . . 3.57 110.293 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.45 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 61.0 mmtt -66.81 -59.0 3.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.526 -0.761 . . . . 2.01 111.737 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 m -140.65 101.98 6.54 Favored Pre-proline 0 C--N 1.311 -1.103 0 CA-C-O 121.274 0.559 . . . . 1.68 109.564 -176.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -43.52 -47.97 8.91 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.32 3.347 . . . . 0.84 112.798 -176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.541 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 11.7 pt-20 -62.86 -39.87 95.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.562 -1.199 . . . . 2.45 112.558 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -72.22 -40.86 67.48 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.758 0.79 . . . . 2.03 109.418 -172.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.08 -34.18 89.26 Favored Glycine 0 N--CA 1.441 -1.005 0 CA-C-N 114.427 -1.261 . . . . 0.41 111.62 176.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.53 -38.14 80.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.748 0.309 . . . . 1.19 110.365 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.0 mmmt -58.01 -60.16 4.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.98 -0.555 . . . . 2.7 110.697 177.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.14 -34.18 65.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 1.12 111.309 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.88 -66.06 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.425 . . . . 1.7 111.237 178.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 69' ' ' MET . 55.5 mtmt -67.04 -32.35 73.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.381 0.61 . . . . 4.35 110.641 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.506 HD12 ' O ' ' A' ' 17' ' ' GLU . 1.4 tp -65.81 -47.03 76.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.21 -0.904 . . . . 2.09 111.196 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -22.57 55.55 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.584 -0.895 . . . . 3.07 108.584 -176.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.23 68.67 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.022 -0.99 . . . . 1.26 110.773 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 31.3 mtm -65.76 -46.99 76.71 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.635 -0.876 . . . . 1.21 108.635 172.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.524 ' HA ' ' HD3' ' A' ' 73' ' ' LYS . 48.3 t -58.06 -44.16 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.446 -1.252 . . . . 0.79 110.098 176.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -63.94 -39.81 95.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.321 -0.854 . . . . 2.03 110.339 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.8 t -58.97 -49.3 78.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.073 -0.512 . . . . 1.66 111.459 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -72.36 -36.27 68.72 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.056 -0.258 . . . . 2.14 111.017 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.9 mt -67.08 -30.23 48.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.085 0.469 . . . . 1.1 110.676 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.43 -30.09 71.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.431 0.634 . . . . 1.18 110.493 173.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.35 -4.5 59.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.277 -0.874 . . . . 1.11 110.697 -178.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 7.4 tp -91.12 139.73 30.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.372 -0.831 . . . . 1.34 109.847 -176.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 155.61 53.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 0.76 111.967 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -44.5 -38.87 12.36 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.824 3.016 . . . . 1.89 113.835 -175.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -65.01 -57.02 9.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.116 0.484 . . . . 2.52 110.357 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 128' ' ' GLY . . . -75.61 -32.37 60.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 1.13 110.961 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -59.72 -39.5 84.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.669 -0.696 . . . . 2.52 110.726 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.28 97.71 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.259 -0.972 . . . . 0.46 111.527 177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.8 t80 -65.4 -41.94 93.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.566 0.222 . . . . 2.04 111.134 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.38 -43.43 79.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 1.07 111.038 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -84.72 -21.22 30.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.309 -0.405 . . . . 1.96 110.756 -177.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -73.61 -45.12 54.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.949 0.404 . . . . 2.74 110.06 176.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.7 p -62.26 -34.21 76.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.231 -0.44 . . . . 0.65 110.616 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.2 mt -68.77 -45.88 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.352 -0.386 . . . . 1.79 111.782 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.15 -29.31 70.69 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.59 -0.444 . . . . 2.82 110.922 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.9 mt -75.68 -44.9 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.15 0.5 . . . . 1.2 109.937 175.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.4 ' O ' ' HD3' ' A' ' 96' ' ' LYS . . . -64.54 -31.2 72.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.829 -0.623 . . . . 1.23 110.864 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -56.59 -51.89 66.93 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.092 -0.503 . . . . 5.02 110.582 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.73 94.7 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.996 -0.621 . . . . 0.72 112.961 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.8 mm -63.83 -52.85 51.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.342 . . . . 1.23 111.095 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.903 ' NZ ' ' HH ' ' A' ' 10' ' ' TYR . 9.9 mptt -83.86 -13.29 53.99 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.311 -0.556 . . . . 3.16 110.806 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.82 -24.94 67.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 118.327 0.512 . . . . 1.33 110.101 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.3 mtp180 -87.77 -24.84 23.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.074 -0.512 . . . . 3.64 110.072 175.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -75.2 -37.97 60.95 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.214 -0.594 . . . . 1.28 109.796 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.648 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 3.3 m-85 -52.85 -27.58 19.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.544 -0.753 . . . . 1.78 112.838 -176.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.629 ' OG1' ' HE3' ' A' ' 38' ' ' LYS . 17.5 p -131.05 32.96 4.23 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 118.427 -1.309 . . . . 1.51 113.273 -176.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 79.62 1.41 86.65 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.699 -0.763 . . . . 1.16 114.003 170.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 90.4 m-20 -88.71 52.81 2.52 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.969 -0.752 . . . . 2.22 108.969 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.456 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 34.3 mt-10 -53.1 115.41 7.45 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 114.469 -1.241 . . . . 1.75 113.395 -169.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 19.4 Cg_endo -64.61 154.07 74.12 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.859 2.373 . . . . 0.71 111.178 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 13.5 t -87.22 173.08 9.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.263 -0.643 . . . . 2.17 109.263 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -64.69 -22.91 67.09 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.224 -0.59 . . . . 3.31 110.787 -175.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -62.79 -44.16 96.91 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.175 -0.306 . . . . 2.24 110.175 175.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -57.26 -44.23 83.71 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.304 0.573 . . . . 1.73 110.214 177.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 mp -68.04 -48.53 65.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.126 -0.943 . . . . 1.56 111.213 -178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -63.94 -32.39 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.018 0.437 . . . . 2.31 110.211 -177.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.07 65.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 1.19 111.423 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.0 p -62.49 -34.86 77.7 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.831 0.308 . . . . 1.84 111.831 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.426 ' CG1' ' HE2' ' A' ' 10' ' ' TYR . 2.7 m -84.49 -24.15 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.674 0.749 . . . . 0.66 109.286 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -62.75 -42.77 99.83 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.126 -0.943 . . . . 2.26 111.28 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.574 ' O ' HD21 ' A' ' 120' ' ' LEU . 21.8 mt-10 -69.1 -36.87 78.02 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 119.985 -0.686 . . . . 2.27 110.975 -178.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -66.12 -27.53 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.103 -0.639 . . . . 0.91 109.844 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.495 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.0 mt -74.59 -37.81 62.79 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.693 -0.484 . . . . 1.75 109.693 172.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -57.83 -42.71 84.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.232 0.539 . . . . 1.51 109.678 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.574 HD21 ' O ' ' A' ' 116' ' ' GLU . 4.2 mm? -69.25 -49.79 53.03 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.343 -0.844 . . . . 1.68 111.347 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.585 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 49.1 t80 -73.47 -29.36 62.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.907 -1.117 . . . . 2.2 111.665 -169.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -70.4 -38.92 74.72 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.588 -0.523 . . . . 2.44 109.588 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -92.15 68.85 5.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.514 0.673 . . . . 1.16 110.985 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.544 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 41.8 mtm -147.77 152.4 37.66 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.978 -1.01 . . . . 1.15 109.325 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.4 m -66.55 140.36 57.97 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.293 -0.262 . . . . 1.57 110.293 175.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -51.53 -42.14 61.56 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.401 0.519 . . . . 2.21 112.401 -168.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.46 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.958 0.355 . . . . 1.18 111.958 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.401 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -82.5 -29.76 35.25 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.89 -0.671 . . . . 0.35 111.537 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -71.06 -47.78 56.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.024 0.44 . . . . 1.84 110.29 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.8 65.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.83 -0.623 . . . . 1.15 111.193 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.16 -31.12 60.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.267 -0.424 . . . . 0.55 110.258 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -61.38 -27.69 68.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.761 -0.654 . . . . 0.49 110.38 176.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.63 -13.31 78.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.066 -0.588 . . . . 0.27 113.303 -178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -87.74 -39.95 14.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.736 0.779 . . . . 2.95 109.536 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -87.37 -36.11 17.97 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.662 -1.154 . . . . 1.83 111.539 -177.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.631 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 25.0 m-85 -128.78 71.67 81.3 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 120.797 0.332 . . . . 0.91 110.693 176.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -61.46 -40.51 47.49 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.906 2.404 . . . . 1.06 112.32 -176.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.615 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 60.5 t80 -62.46 -41.67 98.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 2.9 111.276 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 85.4 mt -76.02 -42.13 48.89 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.639 -0.424 . . . . 1.67 110.383 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.51 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.23 0.538 . . . . 1.04 110.05 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.615 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.6 tttt -49.63 -71.67 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.158 -0.928 . . . . 3.06 111.481 171.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.5 m -64.3 -25.85 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.406 -0.815 . . . . 0.5 112.559 -171.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -71.27 -49.71 40.18 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 119.716 -0.794 . . . . 0.92 110.132 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -73.99 -34.3 64.14 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.298 -0.41 . . . . 2.58 111.2 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.5 t -66.03 -19.54 65.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.223 -0.444 . . . . 1.81 110.502 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.48 4.79 62.15 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.59 -0.814 . . . . 1.41 112.232 178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -64.9 -51.07 63.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.813 0.339 . . . . 2.46 110.303 -179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.39 -40.39 81.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.01 0.433 . . . . 1.07 110.223 177.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.495 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.91 -43.99 81.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.673 -0.694 . . . . 1.12 111.554 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.94 -25.47 61.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.259 -0.428 . . . . 3.27 111.504 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -74.36 -35.54 63.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.049 0.452 . . . . 0.68 110.073 176.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.405 ' HB3' ' CG2' ' A' ' 114' ' ' VAL . . . -81.39 -37.09 28.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 1.18 112.017 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.41 9.24 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 110.297 -1.121 . . . . 1.62 110.297 -169.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 68.17 170.58 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.718 0.807 . . . . 4.12 111.805 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.546 -0.74 . . . . 4.01 109.62 177.139 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 121.002 0.429 . . . . 23.66 110.211 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -108.14 81.59 0.29 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.734 -0.746 . . . . 22.6 112.063 -179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 48.8 m -76.06 75.67 2.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.094 0.474 . . . . 21.85 110.37 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 33.0 t -75.06 106.15 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.866 -0.607 . . . . 20.32 110.479 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -95.24 23.62 5.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.821 -0.627 . . . . 22.01 109.46 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -134.8 26.9 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.28 -0.873 . . . . 18.73 109.73 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -84.29 96.96 9.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.67 -0.695 . . . . 16.62 110.447 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -158.29 146.29 18.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.082 -0.508 . . . . 13.55 109.789 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -118.45 163.62 16.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.446 -0.343 . . . . 12.8 110.379 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -131.56 150.67 52.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.516 -0.311 . . . . 11.87 110.713 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.3 p -104.8 129.18 53.12 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.991 -0.55 . . . . 7.99 110.011 175.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 21.4 m -85.75 -16.44 38.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.0 0.429 . . . . 7.5 110.573 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 79.56 -60.98 4.29 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.876 -0.602 . . . . 4.74 112.187 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -84.46 45.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.945 0.403 . . . . 5.19 110.646 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.433 ' SD ' ' HB2' ' A' ' 30' ' ' LYS . 54.9 tpp -160.94 119.01 2.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 2.17 110.127 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 16.9 p90 -81.53 146.15 30.32 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.288 -0.414 . . . . 2.09 110.178 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.407 ' HA ' ' HZ1' ' A' ' 30' ' ' LYS . 97.9 mttt -121.39 161.59 21.86 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.324 -0.235 . . . . 3.54 110.396 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.666 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 52.6 t80 -54.22 -52.6 60.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 2.56 111.598 -174.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.476 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 68.4 mm-40 -73.88 -0.13 15.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.621 0.6 . . . . 4.16 112.621 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -91.99 -20.47 21.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 2.57 110.407 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.35 138.69 74.89 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.556 -0.905 . . . . 1.31 108.556 176.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -45.31 112.96 0.44 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.15 2.567 . . . . 0.7 112.697 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.02 67.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.732 -0.667 . . . . 1.23 111.471 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -65.25 -35.33 80.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 122.238 1.018 . . . . 1.37 109.283 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.643 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 84.8 t80 -83.92 -28.43 27.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.119 -1.4 . . . . 1.08 110.617 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 53.1 mtp180 -70.0 -18.73 63.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.556 0.693 . . . . 2.1 109.732 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -21.18 63.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.62 -1.173 . . . . 1.02 110.206 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.3 mt -94.05 -26.44 16.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.925 -0.58 . . . . 1.49 110.636 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.8 mtt -62.22 124.93 84.31 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 1.65 110.462 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.38 151.27 65.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.226 1.951 . . . . 1.12 112.529 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' A' ' 18' ' ' ALA . 88.0 Cg_exo -48.89 -50.09 13.5 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 122.851 2.367 . . . . 1.3 112.197 -177.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -77.21 42.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.924 -1.035 . . . . 2.26 111.355 -178.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.427 ' H ' ' C ' ' A' ' 16' ' ' PRO . . . -156.79 -38.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.022 -0.99 . . . . 1.39 108.596 175.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -67.03 -32.09 73.07 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.34 -0.845 . . . . 2.54 110.289 173.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -50.29 -46.91 55.57 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.766 0.666 . . . . 1.06 111.477 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.647 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 43.1 t80 -58.43 -61.47 2.56 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 119.175 -0.44 . . . . 0.73 111.589 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.2 mt -73.33 -9.4 58.66 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 119.614 1.097 . . . . 1.75 112.254 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.61 -40.23 80.51 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.683 -0.488 . . . . 2.56 109.683 163.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -72.34 -54.1 10.44 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.628 -0.714 . . . . 1.84 110.881 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.624 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.6 mm? -53.94 126.58 22.95 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.434 0.635 . . . . 1.7 110.461 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -112.39 -73.59 0.66 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.027 -0.988 . . . . 2.16 111.17 -170.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 3.4 p-10 -140.03 -86.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.587 0.217 . . . . 2.39 111.587 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.458 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -63.01 -14.17 51.7 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 121.475 -0.393 . . . . 1.47 112.708 -178.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.93 -38.07 87.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.286 0.565 . . . . 2.25 109.802 176.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HB2' ' SD ' ' A' ' 0' ' ' MET . 76.5 mttt -77.26 -9.31 58.72 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.443 0.64 . . . . 1.89 110.732 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.406 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 91.3 m -63.78 -45.81 88.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.32 -0.854 . . . . 1.37 109.801 172.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.8 p -75.97 -32.77 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 114.837 -1.074 . . . . 0.85 110.406 -173.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.441 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.5 mm? -53.55 -52.92 58.16 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.245 -0.434 . . . . 1.65 111.443 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 7.7 ptpp? -66.78 -23.68 66.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.553 -0.294 . . . . 2.89 111.573 -175.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.9 mm-40 -72.53 -31.09 65.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.578 0.228 . . . . 1.96 110.796 176.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.8 t -74.06 -53.06 18.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.966 0.888 . . . . 0.98 109.758 174.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 28.3 m-85 -56.47 -42.13 77.71 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 114.628 1.344 . . . . 1.08 114.628 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.496 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 9.5 mtmp? -79.94 7.53 8.72 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.129 -0.628 . . . . 2.71 111.197 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -103.1 -77.18 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.513 -0.767 . . . . 1.57 109.531 170.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.55 -157.48 1.03 Allowed Glycine 0 CA--C 1.523 0.566 0 C-N-CA 120.902 -0.666 . . . . 1.54 112.964 -174.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -91.31 139.69 10.64 Favored 'Cis proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.287 -1.13 . . . . 1.99 111.288 -8.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -110.07 112.24 24.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.5 0.667 . . . . 1.72 111.281 -173.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -72.71 -14.28 61.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.529 -1.214 . . . . 4.11 111.808 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.449 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -145.19 151.78 38.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.814 0.34 . . . . 1.53 111.524 -173.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.7 m -77.97 64.38 3.17 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.919 0.866 . . . . 1.72 110.122 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.449 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 28.0 tt0 -156.72 -43.54 0.07 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.9 -1.045 . . . . 2.24 108.724 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -59.0 -38.89 80.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.416 -0.811 . . . . 2.26 111.012 174.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 m -65.28 -39.56 92.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 1.69 110.02 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.0 -42.1 91.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 1.2 110.335 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.37 -49.62 73.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.788 -1.097 . . . . 1.29 111.307 175.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.97 88.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.431 0.634 . . . . 1.21 110.294 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.438 HD22 HD11 ' A' ' 33' ' ' LEU . 36.6 mt -65.49 -41.53 93.16 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.16 -0.927 . . . . 1.13 111.053 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.35 -38.22 83.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.898 0.38 . . . . 1.87 111.072 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -68.38 -40.86 81.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.599 -0.728 . . . . 3.57 111.387 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.3 mttm -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.862 0.363 . . . . 2.01 111.533 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -138.68 99.58 8.46 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.339 -0.615 . . . . 1.68 109.339 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -46.3 -52.28 7.48 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.992 3.128 . . . . 0.84 112.991 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.87 -34.56 78.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.94 -1.027 . . . . 2.45 112.233 -178.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.8 mt -74.89 -39.67 61.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.103 -1.039 . . . . 2.03 109.774 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.03 -39.0 96.08 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 114.76 -1.109 . . . . 0.41 111.549 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.3 89.3 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.125 -0.324 . . . . 1.19 110.125 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -56.58 -57.38 12.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.581 -0.736 . . . . 2.7 110.761 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -65.74 -30.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 1.12 111.043 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.408 ' O ' ' HD2' ' A' ' 67' ' ' HIS . 41.7 tt0 -63.99 -60.46 3.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.399 -0.364 . . . . 1.7 110.964 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.39 -32.58 73.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.593 0.711 . . . . 4.35 110.213 -174.602 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.491 ' HA ' ' HE1' ' A' ' 69' ' ' MET . 8.4 tp -67.84 -45.57 74.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.993 -1.003 . . . . 2.09 111.818 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.408 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -79.99 -18.99 48.85 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.062 -0.718 . . . . 3.07 109.062 -175.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.99 85.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.004 -0.998 . . . . 1.26 110.521 173.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.493 ' O ' ' HE2' ' A' ' 73' ' ' LYS . 30.8 mtm -59.47 -45.58 91.24 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.443 0.639 . . . . 1.21 109.629 175.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.8 t -56.04 -40.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.028 -0.987 . . . . 0.79 110.548 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -67.27 -31.71 72.22 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.844 -0.616 . . . . 2.03 111.83 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.6 m -55.35 -41.93 73.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.009 0.433 . . . . 1.66 110.713 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.493 ' HE2' ' O ' ' A' ' 69' ' ' MET . 3.0 mmtt -71.06 -43.59 67.5 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 2.14 110.182 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 74.1 mt -70.63 -21.14 22.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.4 0.619 . . . . 1.1 110.898 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.74 43.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.744 0.783 . . . . 1.18 109.547 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 0.26 57.15 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.538 -1.21 . . . . 1.11 110.324 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.427 HD11 ' CG ' ' A' ' 135' ' ' GLN . 9.1 tp -93.07 133.04 36.63 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 1.34 109.818 -175.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.16 158.86 50.35 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.998 -0.62 . . . . 0.76 111.852 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.71 -34.99 22.38 Favored 'Trans proline' 0 N--CA 1.474 0.359 0 C-N-CA 123.611 2.874 . . . . 1.89 113.798 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -65.33 -55.0 20.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.06 0.457 . . . . 2.52 110.187 -178.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.3 -29.54 38.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.628 -0.714 . . . . 1.13 111.168 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.8 ttmt -56.5 -45.9 80.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.963 -0.562 . . . . 2.52 111.017 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.4 -42.07 98.79 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.792 -0.718 . . . . 0.46 111.928 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 16.9 t80 -66.06 -44.62 84.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.196 . . . . 2.04 111.12 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.1 79.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.389 -0.369 . . . . 1.07 111.403 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 26.1 mt-10 -72.35 -35.31 68.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.813 -0.355 . . . . 1.96 110.744 -178.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -66.52 -50.31 63.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.238 -0.437 . . . . 2.74 110.402 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.5 p -67.14 -38.92 86.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 0.65 111.485 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.1 mp -57.23 -39.72 69.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.334 -0.394 . . . . 1.79 111.205 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 63.6 mt-10 -72.31 -30.61 64.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.694 0.283 . . . . 2.82 111.064 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.2 mt -74.59 -55.42 12.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.75 0.31 . . . . 1.2 110.614 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.2 -50.24 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.944 -0.571 . . . . 1.23 111.22 -178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.99 -12.96 61.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.944 -0.571 . . . . 5.02 110.971 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.73 -28.89 56.22 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.446 -0.662 . . . . 0.72 111.446 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -62.7 -49.89 81.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.031 0.443 . . . . 1.23 110.628 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.1 OUTLIER -83.1 4.08 27.9 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.258 -0.428 . . . . 3.16 110.611 177.674 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.693 ' HA ' ' CD2' ' A' ' 100' ' ' TYR . . . -89.08 -33.95 16.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.175 -0.466 . . . . 1.33 110.03 172.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.41 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 5.7 ptp180 -86.85 5.46 36.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.407 -0.59 . . . . 3.64 109.407 174.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.448 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -85.33 -37.72 19.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.304 -0.862 . . . . 1.28 109.323 163.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.639 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 26.8 m-85 -57.36 -40.89 79.03 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.273 0.559 . . . . 1.78 111.201 -176.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.0 p -66.39 -8.31 24.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.055 -0.975 . . . . 1.51 112.687 -172.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 96.57 2.49 60.04 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.665 -0.778 . . . . 1.16 111.265 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -95.43 171.01 8.96 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.356 -0.609 . . . . 2.22 109.356 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -138.66 110.07 8.02 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 116.627 -0.26 . . . . 1.75 110.873 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.41 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 19.5 Cg_endo -61.72 143.22 96.15 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.284 1.989 . . . . 0.71 111.002 173.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.455 ' O ' HD11 ' A' ' 110' ' ' LEU . 48.3 p -75.97 165.27 25.22 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.669 -0.493 . . . . 2.17 109.669 178.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -64.18 -22.39 66.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.861 -0.736 . . . . 3.31 109.972 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 111' ' ' LYS . 38.2 m-20 -72.83 -35.68 67.33 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.23 -0.441 . . . . 2.24 110.365 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -60.51 -42.3 96.11 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.253 -0.647 . . . . 1.73 109.253 173.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.455 HD11 ' O ' ' A' ' 106' ' ' THR . 7.1 mp -65.23 -46.73 79.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 114.987 -1.006 . . . . 1.56 110.704 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 108' ' ' ASP . 50.1 mtpt -55.47 -48.24 74.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.347 -0.388 . . . . 2.31 110.558 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -62.37 -42.38 99.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 1.19 111.455 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.1 p -62.02 -38.59 89.25 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.312 0.486 . . . . 1.84 112.312 -176.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.423 ' CG2' ' HB3' ' A' ' 152' ' ' ALA . 3.7 m -83.21 -23.39 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 122.031 0.92 . . . . 0.66 109.454 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -68.44 -48.74 63.78 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.451 -1.249 . . . . 2.26 111.185 178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.539 ' O ' HD21 ' A' ' 120' ' ' LEU . 7.8 mm-40 -65.21 -35.91 82.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 2.27 110.829 -177.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.2 m -68.12 -26.86 35.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.662 -0.415 . . . . 0.91 110.269 175.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.545 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 73.8 mt -73.44 -37.73 65.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.537 -0.542 . . . . 1.75 109.537 171.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.5 ttpt -57.11 -46.41 82.64 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 109.197 -0.668 . . . . 1.51 109.197 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.539 HD21 ' O ' ' A' ' 116' ' ' GLU . 4.3 mm? -63.21 -55.36 25.67 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.496 -0.774 . . . . 1.68 111.68 170.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.667 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 17.5 t80 -67.86 -36.04 79.6 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 119.626 -0.83 . . . . 2.2 111.936 -166.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -64.11 -25.07 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.668 0.271 . . . . 2.44 111.464 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -93.45 -5.14 49.92 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.633 0.605 . . . . 1.16 112.633 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.474 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 51.5 mtm -74.7 157.39 35.37 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.1 -0.64 . . . . 1.15 111.21 -178.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 3.6 m -59.78 151.79 24.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.167 -0.469 . . . . 1.57 110.134 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -61.38 -40.71 95.33 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.726 -0.389 . . . . 2.21 110.757 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.96 74.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.381 . . . . 1.18 110.683 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.66 -36.84 67.46 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 0.35 111.558 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 124' ' ' MET . 96.6 mttt -66.08 -43.95 85.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.13 0.49 . . . . 1.84 110.391 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.4 -35.92 81.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 1.15 111.346 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.474 ' OD1' ' HD2' ' A' ' 134' ' ' LYS . 35.9 t70 -74.71 -27.97 60.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.268 0.556 . . . . 0.55 110.069 -176.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.79 -30.63 71.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.078 -0.51 . . . . 0.49 110.158 171.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.436 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -70.21 -26.02 74.82 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.27 113.929 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.474 ' HD2' ' OD1' ' A' ' 131' ' ' ASP . 15.1 ptpt -85.86 -32.12 21.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.256 0.55 . . . . 2.95 111.235 -178.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.438 ' HA ' ' NE2' ' A' ' 135' ' ' GLN . 6.7 mm100 -88.17 -41.78 12.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.676 -0.693 . . . . 1.83 110.658 -178.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.624 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 31.1 m-85 -124.37 75.63 61.51 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-O 120.876 0.369 . . . . 0.91 110.465 175.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -62.68 -41.73 29.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.166 2.578 . . . . 1.06 112.713 -174.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.659 ' HD2' ' CD1' ' A' ' 138' ' ' PHE . 46.2 t80 -58.29 -44.8 88.67 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.151 -0.477 . . . . 2.9 111.1 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.79 -42.27 50.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.422 -0.353 . . . . 1.67 110.878 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.436 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.63 -40.75 84.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 1.04 109.94 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 85.9 tttt -46.83 -68.43 0.19 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.947 -1.024 . . . . 3.06 111.26 172.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.0 m -62.83 -28.55 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.646 -0.706 . . . . 0.5 112.637 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -73.09 -49.75 26.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.017 -0.673 . . . . 0.92 110.633 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.4 -32.54 66.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.596 -0.275 . . . . 2.58 111.463 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.4 t -71.4 -26.68 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.198 0.523 . . . . 1.81 110.52 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.05 7.02 56.66 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.604 -0.808 . . . . 1.41 112.226 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -63.35 -48.95 75.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.911 0.386 . . . . 2.46 110.554 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.0 -34.97 71.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 1.07 110.091 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.545 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -58.58 -54.25 49.15 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.57 -0.741 . . . . 1.12 110.466 177.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.34 -41.76 63.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 3.27 111.374 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 151' ' ' PHE . 36.9 t80 -55.7 -46.2 77.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.68 111.269 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.423 ' HB3' ' CG2' ' A' ' 114' ' ' VAL . . . -86.17 -10.0 55.55 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.925 0.713 . . . . 1.18 112.925 -176.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 83.95 28.04 35.8 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.15 -1.024 . . . . 1.62 110.845 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.426 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 20.7 tt0 71.66 175.36 0.29 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.064 0.946 . . . . 4.12 110.46 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.426 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 48.1 t30 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.644 -0.693 . . . . 4.01 110.068 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 15.6 tpt . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 120.778 0.323 . . . . 23.66 110.146 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 133.24 144.92 5.29 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.794 -0.717 . . . . 22.6 111.845 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 16.9 m -119.22 -5.27 10.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.733 0.301 . . . . 21.85 110.999 -178.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 14.8 m -85.09 47.78 1.46 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.527 -0.306 . . . . 20.32 111.553 -174.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -160.47 23.49 0.15 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.01 0.433 . . . . 22.01 111.365 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -118.99 63.59 0.78 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.511 0.672 . . . . 18.73 109.24 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -138.9 121.32 16.07 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.81 -0.632 . . . . 16.62 110.967 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . 0.497 ' HA ' ' OG ' ' A' ' -3' ' ' SER . 40.5 t-80 52.18 79.61 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.617 -0.72 . . . . 13.55 112.379 170.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 47.2 m170 -113.86 -84.8 0.6 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.958 -0.297 . . . . 12.8 111.147 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -143.79 14.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.897 0.38 . . . . 11.87 111.247 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.6 m -131.2 29.89 4.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.23 -0.441 . . . . 7.99 110.152 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.497 ' OG ' ' HA ' ' A' ' -7' ' ' HIS . 15.4 m -85.76 -178.71 6.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.907 -0.588 . . . . 7.5 110.455 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 94.93 40.17 4.41 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.037 -0.825 . . . . 4.74 111.037 -175.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -84.47 -43.88 14.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.794 0.33 . . . . 5.19 110.62 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 0' ' ' MET . 0.5 OUTLIER -151.79 104.4 3.02 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.148 -0.478 . . . . 2.17 110.045 -179.109 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.717 ' HA ' ' OE1' ' A' ' 4' ' ' GLU . 50.9 t80 -49.34 110.11 0.34 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.117 -0.947 . . . . 2.09 111.514 179.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.567 ' HB3' ' HZ2' ' A' ' 2' ' ' LYS . 0.5 OUTLIER -102.57 38.67 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.688 . . . . 3.54 109.527 178.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.663 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 0.4 OUTLIER 58.09 22.2 8.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.04 -1.467 . . . . 2.56 107.04 -159.117 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.717 ' OE1' ' HA ' ' A' ' 1' ' ' PHE . 12.0 mm-40 40.92 28.48 0.05 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 112.623 -2.08 . . . . 4.16 115.076 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 43.08 34.19 0.62 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.209 0.528 . . . . 2.57 110.733 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 99.7 mt -53.29 134.44 51.57 Favored Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 115.887 -0.597 . . . . 1.31 111.405 -174.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -36.23 113.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.035 3.157 . . . . 0.7 112.694 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.07 -15.82 57.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.56 -0.746 . . . . 1.23 111.227 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.97 -34.41 77.7 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.243 1.02 . . . . 1.37 108.903 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.621 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 29.6 t80 -88.81 -33.09 17.54 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 113.58 -1.646 . . . . 1.08 111.122 -175.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.439 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 32.3 mtm180 -68.61 -27.79 66.34 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.25 -0.648 . . . . 2.1 109.25 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.39 -36.15 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.16 -0.927 . . . . 1.02 110.594 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.66 -36.06 60.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.627 -0.715 . . . . 1.49 110.356 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 71.5 mtm -67.74 133.53 92.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.872 -0.603 . . . . 1.65 111.41 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.446 ' HB2' ' OE2' ' A' ' 17' ' ' GLU . 72.2 Cg_endo -76.99 163.83 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.577 2.185 . . . . 1.12 112.075 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.59 -44.23 17.49 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 123.085 2.523 . . . . 1.3 113.229 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 15' ' ' PRO . 2.1 pm0 -71.79 9.23 0.94 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.752 0.649 . . . . 2.26 112.752 -176.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.06 -21.76 4.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.913 0.387 . . . . 1.39 110.736 172.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 63.9 mtp180 -91.89 -44.48 8.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.043 -0.526 . . . . 2.54 110.625 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.431 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 13.3 t70 -50.15 -50.9 47.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.544 -0.753 . . . . 1.06 111.253 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.649 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 41.1 t80 -52.56 -62.14 1.83 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.73 111.799 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 1' ' ' PHE . 13.0 mt -74.59 -6.95 51.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 118.667 0.667 . . . . 1.75 111.05 -175.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.431 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 8.3 tp-100 -75.36 -43.27 51.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.17 0.51 . . . . 2.56 110.739 163.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -64.97 -47.63 76.9 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.583 -0.735 . . . . 1.84 111.842 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.553 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.7 mm? -53.34 132.72 39.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.48 0.657 . . . . 1.7 110.435 177.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -114.1 -72.23 0.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.984 -1.007 . . . . 2.16 112.083 -173.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -140.11 -82.95 0.25 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.624 -0.43 . . . . 2.39 111.802 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.81 -29.89 71.47 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 121.464 -0.398 . . . . 1.47 113.395 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.43 -6.83 50.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.812 0.339 . . . . 2.25 111.12 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.523 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 92.4 mttt -89.48 -24.81 21.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.228 0.537 . . . . 1.89 109.864 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.5 m -62.34 -33.68 75.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.309 -0.86 . . . . 1.37 111.008 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.676 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 4.4 p -75.38 -32.11 25.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.537 -0.301 . . . . 0.85 111.713 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.435 HD11 ' CE2' ' A' ' 37' ' ' PHE . 4.0 mm? -49.88 -51.87 37.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.867 0.321 . . . . 1.65 111.867 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -64.25 -33.04 74.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.758 0.313 . . . . 2.89 110.832 -177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -65.86 -24.7 66.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.509 . . . . 1.96 110.735 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -91.98 -44.43 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.992 -0.549 . . . . 0.98 110.587 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.435 ' CE2' HD11 ' A' ' 33' ' ' LEU . 18.9 m-85 -55.14 -34.49 63.81 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.748 0.647 . . . . 1.08 112.748 173.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -93.15 7.64 43.42 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.087 -0.645 . . . . 2.71 110.921 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.57 12.23 22.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.975 -0.557 . . . . 1.57 110.375 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.85 -158.48 19.44 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.88 -0.676 . . . . 1.54 112.181 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.64 163.58 87.93 Favored 'Cis proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.935 -1.277 . . . . 1.99 112.754 0.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.553 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 45.9 m-85 -121.57 134.78 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.186 -0.915 . . . . 1.72 109.599 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -81.02 -12.02 59.44 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.872 -0.604 . . . . 4.11 110.482 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.552 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -161.0 165.03 30.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.703 -0.681 . . . . 1.53 110.191 -178.415 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.9 m -64.62 -29.59 70.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.222 0.326 . . . . 1.72 111.09 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -53.1 -43.85 67.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.086 -0.506 . . . . 2.24 111.402 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.553 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 29.5 mt-10 -59.43 -42.11 91.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.201 -0.454 . . . . 2.26 111.215 177.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.6 t -66.32 -39.62 89.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.32 -0.4 . . . . 1.69 110.158 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.81 -41.98 93.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.54 . . . . 1.2 110.19 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.9 -50.09 74.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.164 -0.926 . . . . 1.29 111.286 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.94 -39.58 74.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 1.21 110.771 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 29.9 mt -69.24 -40.23 78.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.636 -0.711 . . . . 1.13 111.03 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -63.38 -31.16 72.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.774 0.321 . . . . 1.87 111.779 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.82 -38.16 70.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.176 -0.465 . . . . 3.57 111.061 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.676 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 5.2 tppt? -85.8 -56.02 3.69 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.994 0.426 . . . . 2.01 110.835 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.9 m -127.57 90.72 47.63 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.854 -0.612 . . . . 1.68 109.515 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.66 -55.41 3.58 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 124.31 3.34 . . . . 0.84 113.196 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -63.54 -32.96 74.57 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 114.603 -1.18 . . . . 2.45 112.084 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.7 -39.63 66.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.049 0.928 . . . . 2.03 108.759 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.82 88.3 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.124 -1.398 . . . . 0.41 111.436 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.32 -32.24 72.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.817 0.341 . . . . 1.19 110.662 175.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -66.96 -51.87 49.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 2.7 110.908 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.94 -24.23 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 120.851 0.358 . . . . 1.12 110.684 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -65.1 -59.29 4.28 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.257 -0.429 . . . . 1.7 110.792 177.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -34.84 77.63 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.534 0.683 . . . . 4.35 109.444 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.47 ' CD2' ' HB2' ' A' ' 21' ' ' PHE . 18.0 tp -67.62 -30.35 69.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.691 -1.14 . . . . 2.09 110.657 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -83.58 -37.0 23.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 109.083 -0.71 . . . . 3.07 109.083 -177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.92 83.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.039 -0.982 . . . . 1.26 110.354 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.9 mtp -53.6 -57.96 8.88 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.354 0.597 . . . . 1.21 110.363 173.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.9 t -56.07 -44.85 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 114.794 -1.094 . . . . 0.79 110.881 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -64.63 -42.44 95.47 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 116.053 -0.522 . . . . 2.03 111.698 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.9 m -59.21 -35.26 73.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.168 0.509 . . . . 1.66 110.89 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 88.7 mttt -78.1 -46.7 20.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.729 -0.669 . . . . 2.14 110.552 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.2 mt -66.25 -17.22 22.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 121.844 0.83 . . . . 1.1 110.379 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.16 -34.72 56.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.986 -1.006 . . . . 1.18 110.035 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -85.35 -1.32 56.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.811 -1.086 . . . . 1.11 110.17 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.484 HD12 ' HA ' ' A' ' 132' ' ' PHE . 7.8 tp -96.57 138.64 33.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.544 -0.753 . . . . 1.34 110.417 -175.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.56 152.8 52.44 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.934 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -41.15 -44.99 5.42 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 124.392 3.395 . . . . 1.89 114.368 -176.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 1.0 OUTLIER -69.19 -44.31 72.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 2.52 111.239 -175.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.29 -32.52 55.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.553 0.692 . . . . 1.13 109.817 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -52.33 -51.62 57.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.373 -1.285 . . . . 2.52 111.651 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.84 -40.8 95.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.014 -0.612 . . . . 0.46 112.363 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 14.6 t80 -68.98 -44.1 73.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.391 0.139 . . . . 2.04 110.883 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.431 ' O ' HD11 ' A' ' 89' ' ' ILE . . . -58.05 -37.33 74.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.977 0.418 . . . . 1.07 111.046 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 44.2 mt-10 -68.14 -48.33 65.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.059 -0.519 . . . . 1.96 110.279 178.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -66.05 -44.19 85.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.346 0.498 . . . . 2.74 112.346 -178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 11.8 p -59.79 -45.85 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.86 0.362 . . . . 0.65 110.998 -178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.431 HD11 ' O ' ' A' ' 85' ' ' ALA . 1.6 mp -60.36 -41.88 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.013 -0.539 . . . . 1.79 110.648 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 46.4 mt-10 -64.24 -52.83 56.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.654 0.242 . . . . 2.82 111.654 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 70.6 mt -60.51 -43.85 95.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 120.868 0.366 . . . . 1.2 111.279 -176.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.4 -46.24 73.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.079 0.466 . . . . 1.23 111.17 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -68.65 -25.97 65.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.445 -0.343 . . . . 5.02 111.781 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.64 -36.3 75.7 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.852 -0.69 . . . . 0.72 112.024 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 mm -58.91 -41.32 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.009 0.433 . . . . 1.23 111.145 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.519 ' HB2' ' HZ1' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -96.5 17.88 15.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.117 0.484 . . . . 3.16 110.707 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -102.22 -34.54 9.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.604 -0.725 . . . . 1.33 109.06 169.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.519 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 8.1 ptm180 -83.63 -3.23 57.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 3.64 109.954 174.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.502 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -80.27 -40.08 27.64 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.491 -0.559 . . . . 1.28 109.491 164.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.631 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 2.9 m-85 -68.56 -32.44 72.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.605 -0.725 . . . . 1.78 111.985 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.3 p -65.46 -15.08 62.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 1.51 112.06 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 107.68 10.68 26.42 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 121.11 -0.567 . . . . 1.16 111.816 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 87.5 m-20 -108.53 169.22 8.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.882 -0.414 . . . . 2.22 109.882 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.479 ' OE1' ' HB2' ' A' ' -3' ' ' SER . 38.7 mt-10 -133.15 104.83 12.43 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 121.19 -0.204 . . . . 1.75 111.302 177.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.8 Cg_endo -60.38 139.53 87.08 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 121.744 1.63 . . . . 0.71 110.647 171.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.44 HG23 ' OD2' ' A' ' 109' ' ' ASP . 11.4 t -83.97 176.64 8.72 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.799 -0.445 . . . . 2.17 109.799 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.6 pptp? -63.81 -25.79 68.33 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.511 -0.476 . . . . 3.31 110.644 -176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.87 -35.44 80.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.903 -0.59 . . . . 2.24 110.01 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . 0.44 ' OD2' HG23 ' A' ' 106' ' ' THR . 20.6 m-20 -63.96 -45.69 88.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 1.73 110.587 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.3 mp -66.38 -43.89 84.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 1.56 110.58 178.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.561 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 23.9 ttmm -59.38 -42.95 92.87 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.193 -0.458 . . . . 2.31 110.426 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.498 ' O ' ' HG3' ' A' ' 116' ' ' GLU . . . -68.01 -42.41 80.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.471 -0.332 . . . . 1.19 110.838 177.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.2 t -53.06 -50.26 64.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 1.84 111.096 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.502 ' O ' HD21 ' A' ' 118' ' ' LEU . 3.8 m -77.97 -26.24 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-O 121.534 0.683 . . . . 0.66 109.639 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 62.9 tttm -60.44 -42.33 95.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.368 -0.833 . . . . 2.26 111.074 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 112' ' ' ALA . 29.8 mt-10 -73.39 -37.71 65.88 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.6 -0.44 . . . . 2.27 110.502 -177.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.2 m -66.73 -34.5 70.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.502 -0.479 . . . . 0.91 110.39 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.502 HD21 ' O ' ' A' ' 114' ' ' VAL . 4.0 mm? -71.64 -35.24 70.33 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.062 -0.399 . . . . 1.75 110.225 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -59.31 -40.75 87.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.956 -0.757 . . . . 1.51 108.956 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.41 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -71.9 -53.71 12.3 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.228 -0.896 . . . . 1.68 111.792 172.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.63 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 72.2 t80 -69.53 -37.04 76.95 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 119.916 -0.714 . . . . 2.2 111.914 -165.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -68.66 -28.57 67.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 2.44 110.987 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.32 56.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 1.16 112.136 -176.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 36.6 mtm -74.96 160.15 30.93 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.546 -0.461 . . . . 1.15 111.342 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.0 t -60.05 137.05 58.18 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.011 -0.737 . . . . 1.57 109.011 172.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.5 -39.51 73.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.561 -0.745 . . . . 2.21 111.691 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.59 87.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 1.18 110.606 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.78 66.33 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.639 -0.71 . . . . 0.35 111.46 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -64.96 -45.98 83.47 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.378 0.608 . . . . 1.84 109.714 176.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.59 78.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.387 -0.824 . . . . 1.15 110.529 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.427 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 38.2 t70 -74.16 -33.91 63.64 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.381 -0.6 . . . . 0.55 109.381 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' A' ' 77' ' ' LEU . 82.6 t80 -62.31 -32.39 73.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.735 -0.666 . . . . 0.49 110.343 171.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -70.39 -7.63 60.94 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.27 112.945 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.427 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 79.2 mttt -88.94 -43.45 11.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.361 0.601 . . . . 2.95 109.596 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.514 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.7 mp0 -86.34 -35.75 19.67 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.17 -0.923 . . . . 1.83 111.304 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.613 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 49.5 m-85 -133.95 74.8 68.11 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.218 0.532 . . . . 0.91 110.441 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.92 -31.74 66.68 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 123.243 2.628 . . . . 1.06 112.926 -174.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.61 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 34.9 m-85 -61.88 -44.82 96.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.065 0.394 . . . . 2.9 112.065 -177.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 65.6 mt -72.27 -43.72 63.88 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.506 -0.478 . . . . 1.67 110.191 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.25 -31.51 67.48 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.481 0.657 . . . . 1.04 110.451 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.523 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 25.4 ttmm -61.54 -76.94 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.094 -0.957 . . . . 3.06 111.664 173.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -63.9 -24.35 35.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.173 -0.921 . . . . 0.5 112.636 -169.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -70.82 -41.62 71.32 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.799 -0.36 . . . . 0.92 110.47 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -81.6 -25.22 35.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.455 . . . . 2.58 110.96 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.8 m -69.67 -8.72 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.03 0.443 . . . . 1.81 110.513 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 88.64 -4.06 85.06 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.901 -0.591 . . . . 1.41 113.099 175.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -69.12 -53.94 17.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.731 0.301 . . . . 2.46 111.193 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.0 -39.64 93.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.409 -0.36 . . . . 1.07 110.603 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.44 -42.76 88.07 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.158 -0.474 . . . . 1.12 110.512 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -62.5 -41.7 99.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.826 0.346 . . . . 3.27 110.372 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.667 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 22.6 t80 -62.71 -34.86 78.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.942 -0.572 . . . . 0.68 110.332 177.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' A' ' 115' ' ' LYS . . . -79.48 -34.24 41.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 1.18 111.946 -178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 109.18 26.61 5.13 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.22 -0.752 . . . . 1.62 111.22 -174.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.561 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 29.3 tt0 67.87 174.58 0.27 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.063 0.945 . . . . 4.12 110.272 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.561 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 18.9 m120 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.708 -0.663 . . . . 4.01 109.935 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.508 0.194 . . . . 23.66 110.671 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 156.97 -102.74 0.22 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.296 -0.954 . . . . 22.6 112.199 178.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 14.0 t -86.81 91.38 8.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.124 0.487 . . . . 21.85 110.365 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 16.5 p -121.78 29.0 7.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.562 0.696 . . . . 20.32 109.731 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -80.56 103.23 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.351 -0.841 . . . . 22.01 110.163 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -56.49 -41.45 76.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.569 -0.741 . . . . 18.73 111.86 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -76.12 89.1 3.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.966 0.412 . . . . 16.62 110.874 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -88.9 86.06 6.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.232 -0.44 . . . . 13.55 110.955 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -86.25 76.42 9.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.835 -0.802 . . . . 12.8 108.835 174.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -85.2 95.98 9.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.793 -0.64 . . . . 11.87 110.664 -174.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 11.5 t -141.03 168.27 20.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.029 -0.532 . . . . 7.99 109.815 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.1 p -60.28 125.81 25.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.943 -0.571 . . . . 7.5 111.665 -177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 118.98 -8.23 12.67 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.863 -0.684 . . . . 4.74 112.479 178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -121.49 2.67 10.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.816 0.341 . . . . 5.19 111.318 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.408 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 21.7 ttm -158.23 91.42 1.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.032 -0.531 . . . . 2.17 109.991 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.605 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 18.6 p90 -65.21 156.88 30.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.839 -0.619 . . . . 2.09 111.435 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.523 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 68.5 mttm -118.09 157.0 27.67 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.745 -0.662 . . . . 3.54 109.733 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.664 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 48.9 t80 -66.64 -18.08 65.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.464 0.649 . . . . 2.56 109.736 175.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -84.24 -14.65 49.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.313 -0.858 . . . . 4.16 110.847 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 5.5 m-20 -93.66 -6.03 47.28 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.294 0.569 . . . . 2.57 110.414 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.1 mt -85.49 135.41 38.59 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.325 -0.852 . . . . 1.31 108.952 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -46.24 114.26 0.81 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.199 2.599 . . . . 0.7 112.583 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.97 67.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 1.23 111.713 -176.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -63.86 -36.32 83.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.897 0.856 . . . . 1.37 109.556 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.661 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 74.0 t80 -88.27 -19.03 27.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.097 -1.411 . . . . 1.08 110.618 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -74.53 -25.49 59.37 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.502 0.668 . . . . 2.1 109.557 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.602 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 27.5 t70 -67.16 -25.16 66.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.066 -0.97 . . . . 1.02 110.36 173.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 98.2 mt -87.3 7.68 27.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 1.49 111.013 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.522 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 67.1 mtt -93.79 122.06 63.09 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.452 -0.34 . . . . 1.65 110.143 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.2 150.35 84.96 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.286 1.991 . . . . 1.12 111.159 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -45.87 -45.19 17.53 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.009 2.473 . . . . 1.3 113.246 -172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' OE2' ' HE1' ' A' ' 69' ' ' MET . 3.4 mm-40 -57.89 -50.43 73.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.952 0.406 . . . . 2.26 111.134 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.7 -37.08 70.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 1.39 111.836 -174.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' A' ' 14' ' ' MET . 14.0 ptm180 -76.91 -29.17 55.6 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 121.019 -0.273 . . . . 2.54 111.071 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.477 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 27.9 t70 -56.39 -45.38 80.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.712 0.292 . . . . 1.06 110.553 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.643 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 50.2 t80 -55.58 -60.35 3.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.07 -0.514 . . . . 0.73 111.823 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.496 ' HG ' ' HH ' ' A' ' 100' ' ' TYR . 23.1 mt -73.45 -8.11 54.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 119.791 1.178 . . . . 1.75 112.045 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.477 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 28.1 tt0 -69.07 -38.7 79.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.086 0.469 . . . . 2.56 109.875 163.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -72.15 -54.23 10.32 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.808 -0.633 . . . . 1.84 110.349 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -54.12 130.62 38.86 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.227 -0.897 . . . . 1.7 111.115 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 m -129.96 -82.34 0.55 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.508 -0.769 . . . . 2.16 110.994 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.54 154.59 43.03 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.546 -0.538 . . . . 2.39 109.546 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -45.76 3.52 Favored Glycine 0 C--N 1.322 -0.225 0 C-N-CA 120.462 -0.875 . . . . 1.47 111.694 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.418 ' O ' HD21 ' A' ' 33' ' ' LEU . 3.5 m-20 -67.51 -29.74 69.23 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 2.25 109.534 175.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.451 ' HG3' ' CE1' ' A' ' 1' ' ' PHE . 1.5 mptm? -62.44 -18.07 60.85 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.008 -0.542 . . . . 1.89 110.361 176.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.4 m -74.4 -45.48 46.45 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.757 -0.656 . . . . 1.37 110.318 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.748 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 2.3 p -73.17 -41.77 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 120.281 -0.567 . . . . 0.85 110.917 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.545 HD13 ' CE1' ' A' ' 37' ' ' PHE . 3.8 mm? -55.94 -35.57 66.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.623 0.249 . . . . 1.65 110.837 175.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.441 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 64.2 tttm -70.27 -27.49 64.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.396 -0.365 . . . . 2.89 111.243 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.26 -28.52 14.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.629 0.252 . . . . 1.96 111.676 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.562 ' O ' ' HA ' ' A' ' 39' ' ' ALA . 74.6 t -83.94 -28.12 7.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.153 0.501 . . . . 0.98 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.62 ' HE2' ' CE1' ' A' ' 37' ' ' PHE . 15.0 m-85 -74.39 -24.94 59.2 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 113.895 1.072 . . . . 1.08 113.895 165.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 71.7 mmtt -75.73 -17.81 59.79 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 106.815 -1.55 . . . . 2.71 106.815 165.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.562 ' HA ' ' O ' ' A' ' 36' ' ' VAL . . . 70.16 -79.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 116.94 2.2 . . . . 1.57 116.94 154.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.79 -72.34 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 118.628 -1.749 . . . . 1.54 114.09 -157.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -88.36 172.28 30.9 Favored 'Cis proline' 0 N--CA 1.461 -0.438 0 N-CA-C 115.081 1.147 . . . . 1.99 115.081 7.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.528 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 15.4 m-85 -100.63 155.79 17.68 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.263 -1.335 . . . . 1.72 110.572 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -101.4 -12.01 18.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.72 -0.673 . . . . 4.11 110.707 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.552 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -157.66 161.84 38.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.598 -0.274 . . . . 1.53 111.365 -177.307 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.9 m -60.03 -35.16 74.5 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 123.223 0.327 . . . . 1.72 111.287 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -49.56 -38.63 31.91 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.998 -0.547 . . . . 2.24 112.135 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' HG3' HD22 ' A' ' 44' ' ' ASN . 28.3 mt-10 -70.25 -31.13 68.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.724 -0.217 . . . . 2.26 111.434 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 t -72.72 -43.08 63.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.56 -0.534 . . . . 1.69 109.56 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.39 -43.21 97.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 1.2 109.785 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.9 -48.23 78.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.413 -0.812 . . . . 1.29 111.139 173.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.92 86.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.448 0.642 . . . . 1.21 110.463 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 30.0 mt -68.76 -40.17 79.89 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.957 -1.02 . . . . 1.13 111.215 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -66.32 -22.22 66.27 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.562 -0.455 . . . . 1.87 111.218 177.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -84.4 -33.05 23.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 3.57 110.758 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.748 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 22.8 tptp -90.57 -60.77 1.83 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.886 -0.597 . . . . 2.01 110.769 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.5 p -127.96 85.88 59.54 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 115.87 -0.604 . . . . 1.68 109.713 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.32 -60.02 0.93 Allowed 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 124.051 3.167 . . . . 0.84 113.747 -168.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.33 -26.06 68.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.649 -1.16 . . . . 2.45 111.608 -176.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.484 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 52.7 tp -75.19 -39.48 60.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.655 0.741 . . . . 2.03 109.546 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.18 -32.09 81.31 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.91 -1.041 . . . . 0.41 111.3 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -34.84 78.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.705 -0.247 . . . . 1.19 110.606 174.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 57.8 mttp -61.53 -45.08 95.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.086 0.47 . . . . 2.7 110.072 175.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -71.39 -38.51 69.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.859 -0.61 . . . . 1.12 110.763 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.06 -44.01 90.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.486 . . . . 1.7 111.231 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -66.01 -40.55 91.21 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.079 -0.711 . . . . 4.35 109.079 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 21' ' ' PHE . 61.5 tp -65.25 -35.25 80.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.284 -0.871 . . . . 2.09 110.722 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -73.64 -39.63 64.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.46 -0.941 . . . . 3.07 108.46 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.63 87.14 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.892 -1.049 . . . . 1.26 110.624 176.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.416 ' HE1' ' OE2' ' A' ' 17' ' ' GLU . 21.5 mtp -61.64 -57.61 11.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.306 0.574 . . . . 1.21 110.71 176.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 87.4 t -58.69 -43.7 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 115.515 -0.766 . . . . 0.79 110.708 179.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -64.51 -34.29 77.87 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.931 -0.577 . . . . 2.03 111.563 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 38.2 t -57.98 -48.9 78.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.084 0.469 . . . . 1.66 110.287 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.516 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 62.2 mttm -66.16 -47.73 73.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.559 -0.746 . . . . 2.14 110.529 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.64 -24.51 33.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.244 0.545 . . . . 1.1 111.408 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.92 64.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.468 0.652 . . . . 1.18 110.495 174.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.39 -2.54 58.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.191 -0.913 . . . . 1.11 110.456 -178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.4 tp -95.45 130.51 42.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.686 -0.688 . . . . 1.34 110.041 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.77 152.26 46.02 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.837 -0.696 . . . . 0.76 112.11 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -40.21 -43.28 3.79 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 124.243 3.295 . . . . 1.89 114.397 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -63.9 -44.63 92.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.886 0.374 . . . . 2.52 111.159 -176.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -86.07 -30.82 22.32 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.498 -0.481 . . . . 1.13 110.411 -177.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -57.89 -46.34 85.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.485 -0.779 . . . . 2.52 110.758 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.28 -41.06 94.78 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.885 -0.674 . . . . 0.46 112.067 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.567 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.8 t80 -69.52 -46.38 66.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.981 -0.11 . . . . 2.04 110.967 176.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.93 -47.16 78.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.118 0.485 . . . . 1.07 111.267 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.627 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.3 mt-10 -65.73 -39.66 91.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.795 -0.638 . . . . 1.96 110.704 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -74.3 -42.11 60.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.516 -0.311 . . . . 2.74 111.487 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.1 p -64.37 -39.36 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.912 0.387 . . . . 0.65 110.168 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.33 -39.92 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.773 -0.649 . . . . 1.79 110.215 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.627 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.5 mt-10 -66.48 -45.69 78.82 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 111.465 0.172 . . . . 2.82 111.465 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.9 mt -61.97 -43.15 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.959 0.409 . . . . 1.2 110.546 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.04 -37.94 75.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.237 -0.438 . . . . 1.23 110.015 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -60.05 -43.01 95.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 5.02 110.964 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -63.74 -30.15 76.82 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 121.088 -0.577 . . . . 0.72 112.496 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -68.0 -46.13 82.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.772 0.32 . . . . 1.23 111.35 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 9.9 mptt -82.4 -17.78 44.25 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.576 -0.449 . . . . 3.16 110.199 177.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.442 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . . . -61.86 -37.9 86.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.805 0.336 . . . . 1.33 110.446 171.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 11.7 ptm180 -89.92 7.81 35.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.086 -0.506 . . . . 3.64 110.564 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.419 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 6.5 m-85 -95.38 -41.15 9.15 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.65 -0.871 . . . . 1.28 108.65 162.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.665 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 28.5 m-85 -61.98 -34.72 76.67 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.675 -0.693 . . . . 1.78 111.342 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.3 p -73.56 1.62 9.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.209 -0.45 . . . . 1.51 112.179 -178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.408 ' HA3' ' HE2' ' A' ' 34' ' ' LYS . . . 89.16 6.41 71.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.093 -0.575 . . . . 1.16 112.356 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 80.4 m-20 -96.47 -176.8 3.74 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.049 -0.352 . . . . 2.22 110.049 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.411 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.7 mt-10 -147.3 109.3 3.92 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.606 -0.27 . . . . 1.75 110.997 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 26.2 Cg_endo -64.14 157.31 54.28 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.823 2.349 . . . . 0.71 112.162 174.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 74.4 p -81.31 171.4 14.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.753 -0.462 . . . . 2.17 109.753 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.96 -26.37 68.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.26 -0.644 . . . . 3.31 109.26 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -67.78 -39.16 84.12 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.266 -0.879 . . . . 2.24 110.611 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -59.39 -41.65 89.86 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.177 0.513 . . . . 1.73 110.448 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.96 -45.03 71.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 1.56 110.669 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 28.8 mtpp -57.63 -48.25 79.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.216 -0.447 . . . . 2.31 110.56 177.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 1.19 110.989 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.1 t -54.46 -49.63 69.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 1.84 111.095 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.1 m -81.44 -22.58 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.765 0.793 . . . . 0.66 109.951 -174.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.532 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 46.8 tttm -67.98 -45.68 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.784 -1.098 . . . . 2.26 111.138 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 15.1 mm-40 -70.69 -34.05 71.56 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.623 -0.431 . . . . 2.27 110.656 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 m -65.0 -31.89 55.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.616 -0.433 . . . . 0.91 110.391 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -73.05 -36.27 66.86 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.051 -0.352 . . . . 1.75 110.051 175.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.2 ttmm -59.5 -48.02 83.26 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.026 -0.731 . . . . 1.51 109.026 179.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 11.0 mp -68.54 -45.51 71.96 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.876 -1.056 . . . . 1.68 111.768 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.67 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 10.4 t80 -69.52 -37.04 76.96 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.274 -0.571 . . . . 2.2 111.643 -170.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -65.16 -27.78 68.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 2.44 111.395 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.41 -6.86 59.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.089 -0.505 . . . . 1.16 112.055 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.6 mtm -76.4 153.95 35.27 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 1.15 110.382 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -65.8 150.25 48.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.64 -0.255 . . . . 1.57 110.559 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -54.93 -46.56 74.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.217 0.451 . . . . 2.21 112.217 -171.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.31 -32.97 70.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 1.18 110.926 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.14 -34.16 55.73 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.881 -0.6 . . . . 0.35 111.788 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -64.54 -45.88 85.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.076 0.465 . . . . 1.84 110.359 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.59 -28.19 65.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 1.15 110.86 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.441 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 15.8 t70 -77.31 -35.34 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.505 -0.554 . . . . 0.55 109.505 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -60.57 -31.02 70.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.745 -0.661 . . . . 0.49 110.297 172.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.76 -5.63 69.77 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.098 -0.572 . . . . 0.27 113.248 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.441 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 77.6 mttt -94.74 -42.06 8.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.783 0.802 . . . . 2.95 109.485 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.516 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.9 mp0 -80.96 -40.28 24.72 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.769 -1.105 . . . . 1.83 110.968 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.629 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 45.1 m-85 -130.87 72.88 81.63 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.052 0.453 . . . . 0.91 110.713 176.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -65.47 -32.48 49.38 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.957 2.438 . . . . 1.06 112.964 -176.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.645 ' HD2' ' CD1' ' A' ' 138' ' ' PHE . 44.2 t80 -60.45 -41.77 94.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.916 0.389 . . . . 2.9 110.554 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.1 mt -77.62 -42.84 33.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.245 -0.434 . . . . 1.67 110.533 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.16 -34.58 72.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.058 0.456 . . . . 1.04 110.215 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.7 tttp -52.91 -70.85 0.08 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.223 -0.899 . . . . 3.06 111.477 171.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 3.4 m -62.5 -30.41 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.165 -0.925 . . . . 0.5 112.955 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.6 m-30 -67.1 -47.89 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.134 -0.626 . . . . 0.92 110.216 -179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -72.19 -38.59 69.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 2.58 111.353 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 31.2 t -70.77 -20.68 62.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 1.81 110.705 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 96.66 2.14 60.02 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.751 -0.738 . . . . 1.41 112.372 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.602 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 44.3 tptt -56.98 -46.72 82.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.829 0.347 . . . . 2.46 110.853 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -77.89 -36.94 49.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.141 0.496 . . . . 1.07 110.34 177.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.446 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -57.69 -46.95 83.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.533 -0.758 . . . . 1.12 111.758 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -65.47 -35.49 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 3.27 110.851 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -64.07 -35.37 80.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.304 0.573 . . . . 0.68 109.872 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -78.69 -22.88 46.03 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.662 -0.699 . . . . 1.18 111.683 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 92.48 22.61 28.66 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.277 -0.729 . . . . 1.62 111.277 -174.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -96.39 -128.47 0.15 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.221 0.534 . . . . 4.12 111.644 -175.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.1 p30 . . . . . 0 C--O 1.246 0.886 0 CA-C-N 115.265 -0.879 . . . . 4.01 111.373 -170.638 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 16.1 tpt . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.766 0.317 . . . . 23.66 110.454 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -156.38 -173.98 25.58 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.891 -0.671 . . . . 22.6 111.976 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 12.3 p -89.6 86.32 6.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.911 0.386 . . . . 21.85 110.82 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 30.7 t -70.98 -57.94 4.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.113 -0.494 . . . . 20.32 110.006 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -141.06 -66.47 0.42 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.836 -0.62 . . . . 22.01 109.868 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -170.58 -54.27 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.705 -0.679 . . . . 18.73 110.089 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 50.8 t60 -157.89 146.27 19.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 16.62 109.941 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -79.85 97.84 6.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.496 -0.32 . . . . 13.55 110.34 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -85.76 -70.37 0.6 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.939 0.4 . . . . 12.8 110.734 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -82.41 -12.05 58.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.128 -0.487 . . . . 11.87 110.51 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 18.3 m 66.07 28.27 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.726 -0.67 . . . . 7.99 111.837 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 50.3 m -83.53 88.41 7.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.072 0.463 . . . . 7.5 110.525 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -76.1 111.29 3.26 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.898 -0.668 . . . . 4.74 111.736 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -72.3 95.64 1.74 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.986 0.422 . . . . 5.19 110.252 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 84.9 mmm -93.44 136.66 33.49 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 2.17 109.706 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 7.8 p90 -73.97 146.39 43.92 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.97 -0.559 . . . . 2.09 110.541 -177.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -120.44 139.33 52.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.177 -0.465 . . . . 3.54 109.922 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.66 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 86.3 t80 -65.53 -30.32 71.06 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.409 -0.589 . . . . 2.56 109.409 175.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -74.9 -19.35 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 4.16 110.698 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -89.96 -13.13 36.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.166 0.508 . . . . 2.57 110.0 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 70.8 mt -77.52 129.78 76.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 109.079 -0.712 . . . . 1.31 109.079 175.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.84 113.66 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.336 2.691 . . . . 0.7 112.379 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.36 65.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.711 -0.677 . . . . 1.23 111.686 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.87 -35.57 76.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.745 0.783 . . . . 1.37 110.263 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.66 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 83.9 t80 -85.56 -29.77 23.88 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 114.585 -1.189 . . . . 1.08 111.064 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -68.45 -27.05 65.84 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.196 -0.668 . . . . 2.1 109.196 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.61 -32.27 71.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.312 -1.313 . . . . 1.02 110.615 174.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -80.57 -31.08 36.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.543 -0.753 . . . . 1.49 111.194 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 73.7 mtm -71.21 134.83 84.89 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 1.65 111.33 -176.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.92 146.02 63.99 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.721 2.281 . . . . 1.12 112.265 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -43.74 -49.35 8.11 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 123.721 2.947 . . . . 1.3 113.813 -173.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.538 ' O ' HD22 ' A' ' 66' ' ' LEU . 1.8 pm0 -57.56 -39.41 76.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.798 0.332 . . . . 2.26 111.811 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -14.51 60.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.774 0.321 . . . . 1.39 111.072 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -91.39 -33.71 15.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 2.54 110.299 178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.05 -45.45 32.26 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.579 . . . . 1.06 111.45 178.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.636 ' HE1' ' CE2' ' A' ' 21' ' ' PHE . 38.5 t80 -70.81 1.19 5.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.833 -0.621 . . . . 0.73 112.334 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.524 HD22 ' CE1' ' A' ' 100' ' ' TYR . 71.9 mt -127.83 -16.27 4.72 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.569 -0.707 . . . . 1.75 111.27 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.51 -41.25 98.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.886 -0.783 . . . . 2.56 108.886 164.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -75.58 -51.78 12.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.142 -0.936 . . . . 1.84 112.709 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.454 HD11 HD12 ' A' ' 33' ' ' LEU . 42.0 mt -58.14 142.04 48.43 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.951 0.882 . . . . 1.7 112.79 -172.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.0 p -136.35 -164.55 1.58 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 113.957 -1.474 . . . . 2.16 109.804 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.72 151.52 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.703 0.287 . . . . 2.39 110.432 177.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.43 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . 86.9 -45.56 3.45 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.666 -0.778 . . . . 1.47 112.374 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.67 -37.05 62.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.542 0.687 . . . . 2.25 109.733 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -70.33 -18.02 63.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.633 -0.712 . . . . 1.89 110.194 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 53.1 m -66.89 -40.85 87.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.098 -0.955 . . . . 1.37 111.003 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.428 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 8.3 p -79.23 -27.06 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 0.85 110.631 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.514 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 87.8 mt -56.92 -49.84 74.39 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 111.8 0.296 . . . . 1.65 111.8 177.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.0 pttm -61.09 -25.26 66.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.822 0.344 . . . . 2.89 110.884 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.78 -35.97 75.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.02 0.438 . . . . 1.96 110.438 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.2 t -73.81 -55.89 10.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.575 0.702 . . . . 0.98 110.137 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.514 ' HD2' ' O ' ' A' ' 33' ' ' LEU . 72.9 m-85 -58.27 -46.56 85.81 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 114.763 1.394 . . . . 1.08 114.763 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -77.98 -13.55 59.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 118.501 0.591 . . . . 2.71 111.326 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -79.8 -78.33 0.16 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.325 -0.398 . . . . 1.57 109.997 170.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.94 -157.56 0.37 Allowed Glycine 0 CA--C 1.523 0.54 0 C-N-CA 121.01 -0.614 . . . . 1.54 113.394 -174.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -91.47 172.69 21.91 Favored 'Cis proline' 0 N--CA 1.457 -0.663 0 C-N-CA 124.231 -1.154 . . . . 1.99 111.196 -7.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.49 106.53 8.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.272 0.558 . . . . 1.72 111.671 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -72.71 -18.92 61.49 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.205 -0.907 . . . . 4.11 110.026 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -145.5 157.92 43.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 1.53 109.61 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.5 m -76.13 -27.42 57.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.953 -0.567 . . . . 1.72 111.518 -174.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -58.57 -42.99 89.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.728 0.299 . . . . 2.24 110.842 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.24 -33.81 72.82 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.34 0.59 . . . . 2.26 110.896 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.8 t -74.04 -42.55 60.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 1.69 110.364 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 78.4 mt -64.32 -42.53 95.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.326 0.584 . . . . 1.2 109.886 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.34 -38.05 76.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.137 -0.938 . . . . 1.29 111.381 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.65 -38.08 80.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.412 0.625 . . . . 1.21 110.349 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.81 -35.55 67.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.289 -0.869 . . . . 1.13 111.17 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -63.37 -41.81 98.82 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 121.071 -0.252 . . . . 1.87 111.656 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.71 -33.57 66.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.929 0.395 . . . . 3.57 110.791 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.428 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 29.7 mmtm -77.82 -47.67 18.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.158 -0.474 . . . . 2.01 111.716 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -148.62 95.51 3.98 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-O 120.688 0.28 . . . . 1.68 110.67 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -41.07 -56.53 1.67 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 124.122 3.215 . . . . 0.84 113.827 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.02 -33.26 75.04 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 115.193 -0.912 . . . . 2.45 112.435 -178.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -72.25 -42.36 65.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.8 -0.815 . . . . 2.03 108.8 -176.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.91 -33.99 88.7 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.051 -1.431 . . . . 0.41 111.449 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.1 72.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.763 0.316 . . . . 1.19 110.895 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 26.7 mtpp -67.03 -54.92 17.05 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.595 -0.275 . . . . 2.7 110.337 175.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.6 m -67.61 -22.61 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.166 0 C-N-CA 120.906 -0.318 . . . . 1.12 111.188 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.75 -58.26 9.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.064 -0.516 . . . . 1.7 109.838 172.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -71.95 -32.58 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.798 -0.637 . . . . 4.35 109.969 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.538 HD22 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -62.61 -41.6 99.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 2.09 109.452 179.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -74.3 -38.76 63.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.913 -0.773 . . . . 3.07 108.913 -176.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.33 95.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.821 -1.081 . . . . 1.26 111.014 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 28.9 mtp -55.88 -55.01 37.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.097 0.475 . . . . 1.21 110.8 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.3 t -58.58 -44.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-N 115.149 -0.932 . . . . 0.79 110.554 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -60.54 -37.51 81.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.671 -0.695 . . . . 2.03 111.512 177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.8 m -64.09 -37.78 88.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 1.66 110.859 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.667 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 95.8 mttt -72.44 -23.68 61.1 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.435 -0.348 . . . . 2.14 110.576 177.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.3 mt -89.15 -19.14 7.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.769 0.795 . . . . 1.1 110.159 175.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.03 -36.77 58.95 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.211 -0.904 . . . . 1.18 109.789 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.444 ' HB1' ' OE1' ' A' ' 135' ' ' GLN . . . -90.55 -8.01 51.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.722 -1.126 . . . . 1.11 109.448 -178.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.667 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.8 tp -86.9 121.9 30.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 106.377 -1.712 . . . . 1.34 106.377 172.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.791 ' N ' ' HD3' ' A' ' 79' ' ' PRO . . . -99.21 -12.36 42.53 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.528 1.371 . . . . 0.76 116.528 -172.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.791 ' HD3' ' N ' ' A' ' 78' ' ' GLY . 8.6 Cg_endo -98.97 -146.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.089 0 CA-C-N 121.501 2.651 . . . . 1.89 116.844 -170.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -80.01 -7.07 58.63 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 106.613 -1.625 . . . . 2.52 106.613 167.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 128' ' ' GLY . . . -68.88 -36.49 78.14 Favored 'General case' 0 CA--C 1.499 -0.982 0 CA-C-N 115.361 -0.836 . . . . 1.13 109.467 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.606 ' HD2' ' O ' ' A' ' 77' ' ' LEU . 1.0 OUTLIER -72.42 -36.75 68.69 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.635 -0.711 . . . . 2.52 109.098 177.031 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.36 -43.44 96.83 Favored Glycine 0 C--N 1.336 0.542 0 C-N-CA 120.091 -1.052 . . . . 0.46 111.623 174.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.424 ' CE1' ' HB3' ' A' ' 88' ' ' SER . 8.8 t80 -66.06 -39.05 89.78 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.708 0.403 . . . . 2.04 111.063 176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.55 -43.03 79.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.483 0.658 . . . . 1.07 110.356 177.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 7.4 mm-40 -59.46 -30.88 68.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.008 -0.996 . . . . 1.96 111.108 177.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -87.37 -47.01 9.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.435 -0.348 . . . . 2.74 111.032 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.424 ' HB3' ' CE1' ' A' ' 84' ' ' PHE . 10.1 p -61.11 -47.08 87.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.198 -0.455 . . . . 0.65 111.472 -175.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.0 -40.11 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 1.79 110.279 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -62.8 -45.01 94.63 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.372 -0.377 . . . . 2.82 111.178 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -65.01 -46.56 91.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.579 -0.282 . . . . 1.2 110.932 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.73 88.46 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.299 0.571 . . . . 1.23 110.007 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt85 -59.38 -35.84 74.67 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.346 -0.843 . . . . 5.02 110.78 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.03 -35.34 90.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.018 -0.61 . . . . 0.72 112.474 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.1 mm -71.69 -48.22 53.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.095 0.474 . . . . 1.23 109.921 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -85.23 27.53 0.79 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.668 0.747 . . . . 3.16 110.258 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -117.06 -27.65 6.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 1.33 109.599 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.43 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 17.8 ptp180 -91.47 -1.03 57.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.116 -0.493 . . . . 3.64 109.997 176.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -83.65 -38.59 21.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.999 -0.741 . . . . 1.28 108.999 163.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.612 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 4.4 m-30 -67.86 -24.96 65.31 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.349 -0.841 . . . . 1.78 111.41 -173.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -77.65 -4.58 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.853 -0.612 . . . . 1.51 112.177 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.79 7.83 65.97 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.415 -0.897 . . . . 1.16 111.346 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -100.55 166.0 11.14 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.865 -0.791 . . . . 2.22 108.865 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.4 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 50.2 mt-10 -134.92 110.22 10.93 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 121.028 -0.269 . . . . 1.75 111.297 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.43 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 14.6 Cg_endo -61.55 151.55 79.24 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.416 2.078 . . . . 0.71 111.348 173.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.7 p -81.17 167.57 19.5 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.576 -0.527 . . . . 2.17 109.576 177.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 39.4 ttpt -64.24 -29.64 70.73 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.249 -0.649 . . . . 3.31 109.249 177.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -65.34 -36.28 83.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.241 -0.891 . . . . 2.24 110.896 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -60.69 -44.32 96.66 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.121 0.486 . . . . 1.73 109.985 173.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.32 -40.31 89.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.298 -0.864 . . . . 1.56 111.411 -178.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 94.5 mttt -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.091 0.472 . . . . 2.31 110.238 176.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.538 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -62.51 -43.98 97.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.765 -0.652 . . . . 1.19 111.541 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.2 p -61.77 -32.25 72.51 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.38 0.511 . . . . 1.84 112.38 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 6.9 m -87.63 -25.74 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-O 121.511 0.672 . . . . 0.66 110.126 -178.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.9 ptmm? -79.61 -24.62 41.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.509 -0.769 . . . . 2.26 110.937 -175.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 20.1 mm-40 -78.76 -38.95 37.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.341 -0.543 . . . . 2.27 110.438 175.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.5 m -66.36 -29.43 46.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.611 -0.435 . . . . 0.91 110.017 176.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.91 -40.83 78.89 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.086 -0.709 . . . . 1.75 109.086 172.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 5.4 tmmm? -54.02 -46.56 71.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.731 -0.668 . . . . 1.51 110.289 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.32 -46.82 81.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.384 -0.371 . . . . 1.68 111.342 171.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.659 ' HE1' ' CE2' ' A' ' 121' ' ' TYR . 48.3 t80 -72.54 -33.52 66.91 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 119.739 -0.784 . . . . 2.2 112.41 -167.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -63.77 -32.34 73.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 2.44 110.573 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.95 -4.34 59.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.232 0.827 . . . . 1.16 113.232 -171.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 37.4 mtm -75.53 155.68 35.85 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.093 -0.643 . . . . 1.15 110.712 -178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.6 m -60.79 146.65 45.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.52 -0.309 . . . . 1.57 110.208 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.19 -47.56 75.08 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.25 0.463 . . . . 2.21 112.25 -170.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.94 -33.14 68.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.063 0.459 . . . . 1.18 110.882 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.476 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -72.41 -38.33 58.23 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.477 -0.783 . . . . 0.35 111.651 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.32 -45.95 82.23 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.705 -0.48 . . . . 1.84 109.705 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.75 90.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.605 -0.725 . . . . 1.15 111.461 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.8 -29.92 70.9 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.018 0.437 . . . . 0.55 110.386 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.408 ' HB2' ' HB2' ' A' ' 81' ' ' ALA . 88.6 t80 -58.8 -27.97 65.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.718 -0.673 . . . . 0.49 110.514 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.407 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -68.56 -23.59 75.31 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.243 -0.503 . . . . 0.27 113.145 -178.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.19 21.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.938 0.399 . . . . 2.95 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.444 ' OE1' ' HB1' ' A' ' 76' ' ' ALA . 32.9 mm-40 -82.55 -46.39 13.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.713 -0.676 . . . . 1.83 112.057 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 39.0 m-85 -122.08 73.33 36.67 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 121.144 0.497 . . . . 0.91 110.107 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.69 -25.79 33.66 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.994 2.463 . . . . 1.06 112.895 -171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.632 ' HE2' ' CE1' ' A' ' 138' ' ' PHE . 3.6 m-85 -68.72 -50.6 49.44 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.546 -0.297 . . . . 2.9 111.166 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.478 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -66.39 -44.35 83.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.676 -0.49 . . . . 1.67 109.676 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.407 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -55.34 -46.54 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.016 0.436 . . . . 1.04 110.612 177.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.519 ' HZ2' ' HB2' ' A' ' 141' ' ' LYS . 0.8 OUTLIER -47.59 -67.43 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.252 -0.886 . . . . 3.06 111.447 174.704 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.485 ' HB ' ' CG ' ' A' ' 147' ' ' LYS . 2.7 m -63.93 -23.07 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.014 -0.994 . . . . 0.5 112.798 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.478 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 22.2 m-30 -77.59 -44.54 28.06 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.316 -0.553 . . . . 0.92 110.746 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.07 -35.27 71.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.13 0.49 . . . . 2.58 110.13 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.1 m -82.6 167.57 18.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.37 -0.832 . . . . 1.81 110.307 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -78.79 55.25 4.2 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.895 -0.669 . . . . 1.41 111.502 176.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.485 ' CG ' ' HB ' ' A' ' 142' ' ' VAL . 15.7 tppt? -108.84 -76.3 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.228 -0.286 . . . . 2.46 110.228 -179.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.2 80.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 1.07 110.55 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.33 68.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 1.12 111.471 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -85.44 -38.07 19.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.187 -0.46 . . . . 3.27 111.111 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -58.34 -39.98 80.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.157 0.503 . . . . 0.68 109.783 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.64 -31.52 72.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.444 -0.798 . . . . 1.18 111.093 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 64.24 61.04 6.39 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.938 -0.649 . . . . 1.62 111.673 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.697 ' HG3' ' ND2' ' A' ' 155' ' ' ASN . 3.1 pt-20 -150.37 7.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.13 0.419 . . . . 4.12 112.13 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.697 ' ND2' ' HG3' ' A' ' 154' ' ' GLU . 58.9 m-80 . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.621 -0.704 . . . . 4.01 109.702 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.258 -0.275 . . . . 23.66 110.258 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 74.44 -106.76 2.11 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.775 -0.726 . . . . 22.6 111.501 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.1 t -102.77 85.98 2.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 21.85 110.175 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 19.7 m -125.67 -15.74 5.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.955 -0.566 . . . . 20.32 110.935 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -162.89 41.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.287 . . . . 22.01 111.391 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.98 81.15 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.971 0.415 . . . . 18.73 110.479 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -160.86 70.54 0.39 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.385 0.612 . . . . 16.62 110.522 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -66.36 -28.06 68.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.711 -0.677 . . . . 13.55 109.565 176.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -136.98 115.67 12.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.752 . . . . 12.8 109.366 173.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -115.47 -14.52 11.55 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.822 -0.351 . . . . 11.87 111.092 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 18.4 m -85.26 88.36 7.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 7.99 109.94 178.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 39.1 t -79.99 118.82 22.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.141 -0.481 . . . . 7.5 110.616 -177.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -94.45 14.22 65.75 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.869 -0.682 . . . . 4.74 111.62 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -152.82 55.13 0.78 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.055 0.455 . . . . 5.19 111.041 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 54.7 tpp -65.52 112.59 3.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.677 -0.49 . . . . 2.17 109.677 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.635 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 11.6 p90 -63.18 148.04 49.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.74 -0.664 . . . . 2.09 111.045 -174.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -113.83 165.68 12.33 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.887 -0.597 . . . . 3.54 109.68 177.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.661 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 69.0 t80 -55.33 -51.11 67.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 2.56 110.254 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -77.75 10.32 2.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.868 -0.605 . . . . 4.16 112.463 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -102.04 -19.57 15.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.127 0.489 . . . . 2.57 110.633 -177.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.445 ' HB ' ' HD3' ' A' ' 11' ' ' ARG . 50.9 mt -74.02 138.93 76.01 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.012 -0.736 . . . . 1.31 109.012 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.443 ' HG2' HD21 ' A' ' 110' ' ' LEU . 25.2 Cg_exo -37.69 110.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.492 2.795 . . . . 0.7 112.603 175.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.06 -17.39 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.681 -0.691 . . . . 1.23 111.923 -171.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -69.55 -32.3 71.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.923 0.868 . . . . 1.37 108.911 176.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.668 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 81.1 t80 -82.57 -38.11 24.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.044 -1.435 . . . . 1.08 110.816 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.445 ' HD3' ' HB ' ' A' ' 6' ' ' ILE . 50.6 mtm180 -67.18 -27.99 67.73 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.737 0.78 . . . . 2.1 109.622 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.93 -10.59 59.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.289 -1.323 . . . . 1.02 111.068 176.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.9 mt -97.95 -16.4 19.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.355 . . . . 1.49 110.311 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.417 ' HE1' ' HG2' ' A' ' 11' ' ' ARG . 53.3 mtm -82.24 135.13 47.77 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.316 -0.402 . . . . 1.65 111.209 -174.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.48 160.62 38.38 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.881 2.387 . . . . 1.12 112.489 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -43.65 -49.1 8.2 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 123.255 2.637 . . . . 1.3 112.913 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.18 -60.03 2.76 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.087 0.47 . . . . 2.26 111.412 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 -8.46 54.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 1.39 112.007 -173.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -96.84 -34.66 11.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.502 -0.317 . . . . 2.54 110.749 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -52.05 -47.65 64.99 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.361 0.413 . . . . 1.06 111.645 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.651 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 33.7 t80 -60.56 -60.24 4.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.172 -0.467 . . . . 0.73 111.571 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.454 HD23 ' CE1' ' A' ' 100' ' ' TYR . 34.6 mt -75.82 -4.65 41.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.274 0.943 . . . . 1.75 112.336 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -68.41 -36.19 78.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.498 -0.556 . . . . 2.56 109.498 163.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -78.02 -50.08 12.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.267 -0.879 . . . . 1.84 112.253 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.454 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.4 mm? -55.25 138.04 46.01 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.259 0.552 . . . . 1.7 110.786 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.3 m -121.58 -67.61 0.95 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 2.16 111.278 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -164.07 -52.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.74 0.274 . . . . 2.39 111.74 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -70.03 -30.8 69.69 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.829 -0.7 . . . . 1.47 111.552 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -72.53 -41.65 65.6 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.179 -0.511 . . . . 2.25 110.526 175.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.26 -20.68 63.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.13 0.49 . . . . 1.89 110.776 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 58.2 m -67.8 -30.07 69.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.631 -0.713 . . . . 1.37 110.936 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.81 -30.12 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-N 116.29 -0.414 . . . . 0.85 110.773 -178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.92 -45.85 71.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.351 0.12 . . . . 1.65 110.967 173.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 17.8 pttp -59.9 -27.08 66.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.591 -0.444 . . . . 2.89 110.959 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -78.18 -39.02 42.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.8 0.333 . . . . 1.96 110.439 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.3 m -69.83 -37.41 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.98 110.219 179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 24.9 m-85 -67.49 -38.22 84.03 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.238 1.199 . . . . 1.08 114.238 173.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.496 ' HB2' ' HZ3' ' A' ' 38' ' ' LYS . 10.0 mtmp? -85.25 16.87 3.33 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.627 -0.829 . . . . 2.71 110.291 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.93 11.57 17.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 1.57 109.541 174.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.69 -159.97 32.72 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.521 -0.763 . . . . 1.54 111.849 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.55 160.0 93.89 Favored 'Cis proline' 0 C--O 1.233 0.274 0 C-N-CA 123.675 -1.386 . . . . 1.99 112.839 1.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.536 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 60.0 m-85 -116.6 140.92 48.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.629 -0.714 . . . . 1.72 110.106 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.3 -12.97 60.16 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.634 -0.712 . . . . 4.11 110.289 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.547 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -158.06 165.58 34.68 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.116 -0.493 . . . . 1.53 110.286 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -65.89 -30.15 70.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.118 0.485 . . . . 1.72 110.588 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -54.08 -42.82 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.435 -0.802 . . . . 2.24 112.087 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.547 ' HG3' HD22 ' A' ' 44' ' ' ASN . 30.3 mt-10 -63.76 -33.14 74.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.418 -0.355 . . . . 2.26 111.131 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.5 t -73.21 -32.23 64.66 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.849 -0.426 . . . . 1.69 109.849 177.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.7 -40.84 90.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.406 0.622 . . . . 1.2 109.556 175.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.81 -46.18 90.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.035 -0.984 . . . . 1.29 110.879 175.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.77 -39.14 73.49 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.053 -0.522 . . . . 1.21 110.973 177.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.1 mt -71.21 -42.25 69.2 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 1.13 111.448 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -61.14 -34.66 75.35 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.874 0.368 . . . . 1.87 111.429 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -73.95 -38.29 64.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.056 -0.52 . . . . 3.57 111.657 -179.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -91.48 -36.89 13.49 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.228 0.455 . . . . 2.01 112.228 -175.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -145.18 88.27 6.83 Favored Pre-proline 0 C--N 1.32 -0.715 0 N-CA-C 109.336 -0.616 . . . . 1.68 109.336 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.483 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 63.1 Cg_exo -41.18 -54.41 2.59 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 124.102 3.201 . . . . 0.84 113.751 -170.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.601 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 6.1 mp0 -58.96 -36.0 74.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.945 -1.025 . . . . 2.45 112.326 -177.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.55 -36.6 79.01 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 120.011 -0.676 . . . . 2.03 109.315 -175.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.13 81.52 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.639 -1.164 . . . . 0.41 111.707 176.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 -38.79 63.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.75 0.31 . . . . 1.19 110.547 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.4 mmmt -63.2 -42.12 99.28 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.116 -0.493 . . . . 2.7 110.602 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.63 -30.07 16.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.392 -0.367 . . . . 1.12 110.718 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.46 -51.86 63.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.549 -0.296 . . . . 1.7 110.628 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.483 ' O ' ' HG3' ' A' ' 69' ' ' MET . 20.9 pttp -60.11 -35.49 75.34 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.774 0.797 . . . . 4.35 109.573 -177.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.492 HD11 ' C ' ' A' ' 66' ' ' LEU . 1.5 tm? -65.04 -48.5 73.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.387 -1.279 . . . . 2.09 110.303 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.574 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 84.2 t60 -77.98 -32.12 51.09 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.52 -0.548 . . . . 3.07 109.52 -170.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.37 93.6 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.379 -0.828 . . . . 1.26 111.528 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.483 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 60.7 mtm -56.32 -52.15 65.59 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.649 0.738 . . . . 1.21 109.367 174.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t -51.66 -49.47 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 114.107 -1.406 . . . . 0.79 110.917 176.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.574 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.1 mmmt -63.2 -40.63 98.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.749 . . . . 2.03 111.928 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.9 t -60.56 -40.05 90.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.022 0.439 . . . . 1.66 110.666 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.534 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 95.2 mttt -74.0 -41.71 61.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.836 -0.62 . . . . 2.14 110.788 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -69.93 -26.24 29.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.196 0.522 . . . . 1.1 110.807 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.6 81.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.579 0.704 . . . . 1.18 109.924 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.07 -2.29 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.743 -1.117 . . . . 1.11 110.743 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 11.7 tp -95.05 133.28 39.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.823 -0.626 . . . . 1.34 109.731 -176.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.41 151.2 50.54 Favored Glycine 0 C--O 1.226 -0.394 0 C-N-CA 120.8 -0.714 . . . . 0.76 112.0 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -39.17 -40.4 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.391 3.394 . . . . 1.89 114.495 -176.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -70.02 -46.24 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.263 -0.175 . . . . 2.52 111.236 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.29 -33.17 37.91 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.606 0.717 . . . . 1.13 109.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -58.03 -44.4 87.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.676 -1.147 . . . . 2.52 111.304 177.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.23 -38.83 96.29 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 0.46 111.927 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 15.4 t80 -68.47 -44.05 75.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.526 0.203 . . . . 2.04 110.998 176.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.22 85.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.034 0.445 . . . . 1.07 111.024 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -62.46 -39.71 94.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.83 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -71.06 -51.28 26.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 2.74 111.529 -177.263 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.3 p -59.15 -39.91 83.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.952 0.406 . . . . 0.65 110.997 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.7 mt -70.34 -41.03 78.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 116.091 -0.504 . . . . 1.79 111.603 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 14.8 pt-20 -69.68 -28.01 65.49 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.454 -0.498 . . . . 2.82 110.668 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 98.2 mt -69.77 -48.96 61.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.014 0.435 . . . . 1.2 110.044 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.49 -33.93 76.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.92 -0.582 . . . . 1.23 110.734 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -56.96 -39.78 75.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.955 -0.566 . . . . 5.02 110.38 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 98' ' ' ARG . . . -66.98 -30.72 76.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.927 -0.654 . . . . 0.72 112.015 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -63.53 -53.8 40.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.075 0.464 . . . . 1.23 110.542 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -74.48 -15.67 60.88 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.361 -0.382 . . . . 3.16 110.863 177.672 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.03 71.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 119.936 -0.706 . . . . 1.33 109.989 170.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.483 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 47.1 mtt180 -88.77 -9.43 51.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.184 -0.462 . . . . 3.64 110.186 176.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.471 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 30.6 m-85 -83.25 -43.94 15.51 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.392 -0.596 . . . . 1.28 109.392 167.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.67 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 25.8 m-85 -61.08 -36.3 79.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.192 -0.458 . . . . 1.78 111.778 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 1.8 p -74.49 -11.44 60.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 1.51 112.737 -176.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.14 58.76 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.839 -0.696 . . . . 1.16 113.225 -176.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -88.71 -42.89 11.68 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.907 0.354 . . . . 2.22 111.236 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 65.41 88.88 0.11 Allowed Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 123.728 0.642 . . . . 1.75 112.321 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.94 144.43 5.96 Favored 'Trans proline' 0 C--O 1.237 0.457 0 C-N-CA 123.62 2.88 . . . . 0.71 113.019 172.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.7 t -79.61 166.0 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.047 -0.723 . . . . 2.17 109.047 174.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.521 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 22.0 ptmt -58.03 -34.44 70.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.283 0.492 . . . . 3.31 110.496 -176.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.99 -25.55 66.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.746 -0.661 . . . . 2.24 111.493 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -70.16 -40.59 74.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.347 0.594 . . . . 1.73 109.982 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.458 HD22 ' CG ' ' A' ' 10' ' ' TYR . 9.9 mp -72.41 -39.68 67.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 1.56 110.716 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.0 mtpm? -58.32 -47.02 85.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.229 0.538 . . . . 2.31 110.021 176.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -64.53 -39.25 93.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.532 -0.758 . . . . 1.19 112.301 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.9 p -71.88 -31.9 66.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.396 0.517 . . . . 1.84 112.396 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 5.9 m -78.41 -24.43 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.458 0.647 . . . . 0.66 109.307 179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.565 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 63.5 mttm -53.26 -48.78 67.99 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.276 -0.874 . . . . 2.26 111.385 174.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.512 ' O ' HD11 ' A' ' 120' ' ' LEU . 6.4 mm-40 -70.27 -33.42 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.391 -0.368 . . . . 2.27 110.922 -171.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.3 m -67.95 -28.03 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 C-N-CA 120.231 -0.588 . . . . 0.91 109.95 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 149' ' ' ALA . 44.3 mt -82.35 -30.31 30.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.81 0.338 . . . . 1.75 110.283 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -61.49 -35.42 77.61 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.607 0.718 . . . . 1.51 109.264 177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.6 ' O ' ' HG3' ' A' ' 124' ' ' MET . 10.8 mp -81.87 -45.7 15.13 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 114.755 -1.111 . . . . 1.68 111.369 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.625 ' HD2' ' CD1' ' A' ' 121' ' ' TYR . 47.4 t80 -74.63 -36.32 62.91 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 119.301 -0.96 . . . . 2.2 111.611 -169.106 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -66.66 -29.49 69.51 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.221 -0.659 . . . . 2.44 109.221 176.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -102.22 72.1 1.28 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.189 -0.914 . . . . 1.16 110.809 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.6 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 32.0 mtm -150.02 157.47 43.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.691 -0.686 . . . . 1.15 110.669 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.4 m -62.57 138.35 58.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.228 0.537 . . . . 1.57 110.445 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -58.49 -37.88 76.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.128 -0.942 . . . . 2.21 112.533 -172.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.92 -34.83 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 1.18 110.834 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.69 -38.69 56.86 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.985 -0.626 . . . . 0.35 111.64 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.79 -45.22 90.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.042 0.448 . . . . 1.84 110.608 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.0 71.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.77 -0.65 . . . . 1.15 111.782 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -74.23 -30.72 62.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.55 109.823 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -60.32 -31.08 69.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.912 -0.586 . . . . 0.49 109.928 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.75 -12.03 73.95 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 121.092 -0.575 . . . . 0.27 112.849 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -86.51 -33.29 20.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.58 0.705 . . . . 2.95 109.781 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.6 mm-40 -92.25 -38.8 11.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.001 -1.0 . . . . 1.83 110.934 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.656 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 71.4 m-85 -131.26 75.14 78.19 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-O 121.215 0.531 . . . . 0.91 110.166 177.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -66.86 -29.38 41.77 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.433 2.756 . . . . 1.06 113.043 -175.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.658 ' HE2' ' CE1' ' A' ' 138' ' ' PHE . 26.0 t80 -74.45 -37.04 63.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.949 0.404 . . . . 2.9 109.933 -177.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.0 mt -74.9 -46.64 34.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 1.67 110.302 177.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.492 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.95 -39.16 74.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 1.04 109.907 177.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 55.2 tttp -44.4 -68.31 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.131 -0.94 . . . . 3.06 111.701 172.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.2 m -71.9 -16.24 18.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 114.997 -1.001 . . . . 0.5 112.753 -173.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.466 ' HB3' ' CD2' ' A' ' 121' ' ' TYR . 22.3 m-30 -84.95 -36.41 21.41 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.433 -0.507 . . . . 0.92 110.941 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 48.0 mt-10 -66.42 -52.35 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.081 0.467 . . . . 2.58 109.881 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -75.16 159.45 31.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.682 -0.69 . . . . 1.81 109.929 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.07 52.41 3.32 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.738 -0.744 . . . . 1.41 111.828 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -100.06 -64.25 1.06 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.789 0.328 . . . . 2.46 110.155 -176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.45 -33.76 69.64 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.301 0.572 . . . . 1.07 109.544 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.436 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -55.79 -37.91 69.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.098 -0.956 . . . . 1.12 111.55 177.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -85.81 -20.21 29.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.541 -0.3 . . . . 3.27 111.413 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -74.34 -34.07 63.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.532 0.682 . . . . 0.68 109.316 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -79.92 -42.53 23.89 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.189 -0.914 . . . . 1.18 111.565 177.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 100.3 1.44 55.72 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.616 -0.994 . . . . 1.62 110.616 -170.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -88.29 128.25 35.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.054 -0.573 . . . . 4.12 110.137 -177.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.515 HD21 ' N ' ' A' ' 155' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 119.045 -0.502 . . . . 4.01 109.834 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.519 0.2 . . . . 23.66 110.481 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.55 81.24 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 22.6 111.867 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 15.7 m -126.75 136.38 52.34 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.351 -0.611 . . . . 21.85 109.351 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 16.1 t -75.67 87.11 2.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.137 0.494 . . . . 20.32 110.317 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -75.81 156.8 34.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.82 -0.627 . . . . 22.01 110.744 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -86.61 132.26 33.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.038 -0.528 . . . . 18.73 109.685 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -69.47 103.16 1.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.698 0.761 . . . . 16.62 110.976 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -70.11 134.64 48.39 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.316 -0.856 . . . . 13.55 110.411 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -84.06 130.76 34.85 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.277 -0.42 . . . . 12.8 110.489 -178.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -114.0 -63.86 1.39 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.007 -0.542 . . . . 11.87 109.788 178.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.1 91.64 8.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.091 0.472 . . . . 7.99 110.029 174.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.6 m -103.44 140.59 37.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.936 -0.575 . . . . 7.5 110.673 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 158.23 -96.24 0.15 Allowed Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.991 -0.623 . . . . 4.74 111.55 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -113.75 85.39 2.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.028 0.442 . . . . 5.19 110.511 178.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 7.5 tpt -144.88 129.61 18.18 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.674 -0.694 . . . . 2.17 109.513 -178.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.75 ' CD1' ' HG2' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -44.48 94.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 O-C-N 124.185 0.928 . . . . 2.09 111.325 177.79 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 tmtp? -100.94 50.5 0.87 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.692 -1.14 . . . . 3.54 109.435 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.639 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 0.9 OUTLIER 62.06 23.44 13.82 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 107.289 -1.374 . . . . 2.56 107.289 -166.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.75 ' HG2' ' CD1' ' A' ' 1' ' ' PHE . 16.0 mm-40 46.64 17.79 0.06 Allowed 'General case' 0 C--N 1.344 0.335 0 N-CA-C 116.441 2.015 . . . . 4.16 116.441 171.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.9 t70 48.97 29.98 2.59 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.47 0.652 . . . . 2.57 109.9 -172.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 83.2 mt -52.71 132.75 46.78 Favored Pre-proline 0 CA--C 1.519 -0.229 0 CA-C-N 115.673 -0.694 . . . . 1.31 110.376 -174.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -35.22 109.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 123.982 3.121 . . . . 0.7 112.899 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.29 -17.02 51.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.59 -0.732 . . . . 1.23 111.597 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -67.7 -35.46 78.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.703 . . . . 1.37 109.275 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.622 ' HE1' ' CE2' ' A' ' 10' ' ' TYR . 41.4 t80 -89.1 -24.45 22.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.383 -1.28 . . . . 1.08 111.098 -176.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -71.21 -22.93 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.041 -0.725 . . . . 2.1 109.041 177.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -24.52 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.774 -1.103 . . . . 1.02 110.541 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 10' ' ' TYR . 9.9 mp -80.37 -43.89 20.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.481 -0.781 . . . . 1.49 110.669 178.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 69.8 mtm -68.36 131.54 91.77 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 1.65 110.844 -177.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.417 ' HD3' HD23 ' A' ' 139' ' ' LEU . 26.9 Cg_endo -63.24 152.44 79.78 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 1.12 111.989 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_exo -53.08 -27.46 36.65 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.621 2.88 . . . . 1.3 112.847 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.539 ' O ' HD22 ' A' ' 66' ' ' LEU . 31.0 mt-10 -64.59 -50.17 68.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.898 -0.592 . . . . 2.26 110.641 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.65 70.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.998 0.428 . . . . 1.39 110.978 -178.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -75.64 -32.77 60.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.606 -0.725 . . . . 2.54 110.505 179.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -52.5 -45.9 66.41 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.866 -0.606 . . . . 1.06 111.318 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 44.1 t80 -57.72 -63.21 1.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.952 -0.567 . . . . 0.73 111.657 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.477 HD23 ' CE1' ' A' ' 100' ' ' TYR . 48.9 mt -73.45 -9.91 59.18 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 119.539 1.063 . . . . 1.75 112.484 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.94 -36.89 80.9 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.013 0.435 . . . . 2.56 110.059 164.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -80.47 -48.76 12.34 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.958 -0.564 . . . . 1.84 111.142 -178.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.561 ' HB3' ' CE ' ' A' ' 30' ' ' LYS . 4.4 mm? -57.61 131.52 50.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.439 0.637 . . . . 1.7 111.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.6 m -130.79 -90.39 0.45 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.341 -0.845 . . . . 2.16 111.351 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -125.08 -62.13 1.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.086 0.402 . . . . 2.39 112.086 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -61.75 -45.63 95.86 Favored Glycine 0 N--CA 1.453 -0.168 0 C-N-CA 121.101 -0.571 . . . . 1.47 113.109 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -72.49 -32.61 66.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.22 0.533 . . . . 2.25 110.276 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.561 ' CE ' ' HB3' ' A' ' 25' ' ' LEU . 1.1 tppp? -55.54 -34.84 65.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 1.89 111.049 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.6 m -51.99 -41.87 62.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.128 -0.942 . . . . 1.37 112.292 176.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.528 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.0 p -86.68 -24.2 6.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.464 -0.335 . . . . 0.85 111.49 -171.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.476 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.3 mm? -49.92 -53.08 28.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.789 0.328 . . . . 1.65 111.873 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -64.06 -21.08 66.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 2.89 111.373 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -76.66 -22.08 54.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.19 -0.459 . . . . 1.96 110.829 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.6 t -91.84 -52.3 10.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.578 0.704 . . . . 0.98 110.189 177.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.65 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 64.8 m-85 -58.24 -39.58 79.5 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.941 1.089 . . . . 1.08 113.941 177.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -85.07 16.89 3.2 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.847 -0.741 . . . . 2.71 110.862 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.78 21.0 11.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.557 -0.747 . . . . 1.57 109.945 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.77 -153.91 9.95 Favored Glycine 0 N--CA 1.452 -0.242 0 N-CA-C 111.32 -0.712 . . . . 1.54 111.32 174.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -83.52 150.64 65.58 Favored 'Cis proline' 0 C--N 1.344 0.318 0 CA-C-N 119.331 1.565 . . . . 1.99 112.761 -2.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -86.5 134.14 33.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.915 -0.584 . . . . 1.72 110.011 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -89.27 -17.36 29.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.315 -0.857 . . . . 4.11 109.219 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.475 HD22 ' HG3' ' A' ' 47' ' ' GLU . 4.8 p30 -145.99 163.37 35.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.28 -0.873 . . . . 1.53 110.011 -177.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.0 m -65.55 -41.81 92.58 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 1.72 111.436 -177.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -55.7 -34.92 65.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 2.24 112.534 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.475 ' HG3' HD22 ' A' ' 44' ' ' ASN . 31.6 mt-10 -56.76 -39.49 74.13 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.034 0.383 . . . . 2.26 112.034 -177.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.2 t -69.04 -43.87 73.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.958 0.409 . . . . 1.69 109.931 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.1 mt -64.52 -44.11 96.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.692 -0.686 . . . . 1.2 110.375 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.29 79.5 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.141 -0.936 . . . . 1.29 112.069 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.99 -34.76 79.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.937 0.399 . . . . 1.21 110.81 -177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.403 HD22 HD11 ' A' ' 33' ' ' LEU . 16.9 mt -69.49 -32.2 70.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.912 -0.586 . . . . 1.13 111.318 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -67.44 -40.73 85.44 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.836 -0.346 . . . . 1.87 111.188 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -66.4 -28.51 68.68 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.223 0.535 . . . . 3.57 110.869 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.528 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 40.3 mmtt -85.69 -44.12 12.83 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.892 -0.595 . . . . 2.01 112.043 176.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -151.5 103.93 2.91 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 120.712 -0.395 . . . . 1.68 111.361 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -41.31 -62.69 0.37 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 123.87 3.047 . . . . 0.84 113.485 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.36 -29.24 69.94 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.801 -1.09 . . . . 2.45 111.387 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tt -73.22 -42.18 62.91 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.407 -0.96 . . . . 2.03 108.407 -176.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.45 -25.6 71.44 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 114.353 -1.294 . . . . 0.41 111.467 175.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.78 -32.03 63.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.938 0.399 . . . . 1.19 110.444 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -67.7 -37.99 83.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.282 -0.417 . . . . 2.7 111.178 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -80.13 -29.56 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.176 0.512 . . . . 1.12 110.061 175.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.15 -48.91 79.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.86 -0.609 . . . . 1.7 110.782 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.17 -30.57 71.16 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 121.397 0.617 . . . . 4.35 109.432 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.539 HD22 ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -73.33 -3.85 29.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.075 -0.966 . . . . 2.09 111.872 -178.17 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -122.13 -29.68 4.17 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.126 -0.63 . . . . 3.07 110.487 171.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.37 -47.34 64.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.659 0.244 . . . . 1.26 111.659 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 35.7 mtm -62.63 -39.33 93.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.747 0.784 . . . . 1.21 109.484 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.0 t -69.55 -35.49 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 114.709 -1.132 . . . . 0.79 110.583 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.12 -39.65 90.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.947 -0.57 . . . . 2.03 110.568 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -55.44 -36.5 66.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.413 0.625 . . . . 1.66 110.371 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 43.7 mttp -77.69 -54.25 6.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.996 -1.002 . . . . 2.14 110.118 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.4 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.6 mt -61.76 -23.2 30.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 1.1 111.361 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.82 65.5 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.66 -0.7 . . . . 1.18 109.856 177.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.85 -2.98 52.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.813 -1.085 . . . . 1.11 110.016 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 132' ' ' PHE . 6.8 tp -91.23 135.46 33.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.001 -0.999 . . . . 1.34 109.58 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.68 159.75 48.24 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.803 -0.713 . . . . 0.76 111.829 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -47.73 -38.22 29.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.304 2.669 . . . . 1.89 113.227 -177.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -63.53 -47.73 80.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.343 -0.39 . . . . 2.52 111.228 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 128' ' ' GLY . . . -87.05 -29.79 21.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.104 -0.498 . . . . 1.13 111.419 -174.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.0 ttpt -57.87 -41.74 83.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.09 -0.505 . . . . 2.52 111.319 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.09 -41.26 96.45 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.564 -0.826 . . . . 0.46 112.083 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -71.57 -41.56 68.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.801 -0.2 . . . . 2.04 111.057 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.445 ' O ' HD11 ' A' ' 89' ' ' ILE . . . -57.81 -49.57 76.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.871 0.367 . . . . 1.07 111.666 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.93 -29.3 69.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.353 -0.385 . . . . 1.96 111.522 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.686 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.4 OUTLIER -88.42 -38.29 15.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 111.743 0.275 . . . . 2.74 111.743 -176.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.5 p -60.3 -39.8 88.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.101 0.477 . . . . 0.65 109.769 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.445 HD11 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -63.82 -41.32 92.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.681 -0.69 . . . . 1.79 110.879 175.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.686 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 8.0 pt-20 -67.16 -32.72 74.01 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.837 -0.345 . . . . 2.82 110.736 -177.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 74.3 mt -73.23 -52.31 22.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.82 0.343 . . . . 1.2 110.546 177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.8 -43.34 98.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.076 -0.511 . . . . 1.23 111.206 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.444 ' O ' ' HB3' ' A' ' 97' ' ' ALA . 12.3 ptt180 -66.3 -23.38 66.37 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.132 -0.485 . . . . 5.02 110.454 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.0 -41.33 55.0 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.005 -0.617 . . . . 0.72 112.137 -179.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.0 mm -65.61 -44.39 93.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.818 0.818 . . . . 1.23 109.125 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 14.8 ttpp -88.45 29.03 1.02 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.673 -1.148 . . . . 3.16 109.887 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 93' ' ' ARG . . . -121.75 -34.48 3.39 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.113 -0.949 . . . . 1.33 110.567 168.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.619 ' O ' ' HB3' ' A' ' 103' ' ' ASN . 17.1 ptm180 -80.88 0.07 36.81 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 120.194 -0.602 . . . . 3.64 109.498 176.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.474 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 5.6 m-85 -81.27 -28.78 34.56 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.024 -0.361 . . . . 1.28 110.024 165.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.66 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 30.9 m-85 -72.44 -34.18 67.59 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.963 0.411 . . . . 1.78 111.272 -178.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.4 p -73.53 -12.08 60.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.659 -0.701 . . . . 1.51 112.554 -173.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.78 55.08 Favored Glycine 0 N--CA 1.453 -0.232 0 N-CA-C 111.103 -0.799 . . . . 1.16 111.103 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.619 ' HB3' ' O ' ' A' ' 98' ' ' ARG . 40.6 t-20 -87.89 162.3 17.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.038 -1.097 . . . . 2.22 108.038 176.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -139.46 97.92 8.26 Favored Pre-proline 0 C--N 1.32 -0.705 0 O-C-N 122.114 -0.366 . . . . 1.75 110.84 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -57.05 139.89 91.17 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.443 2.095 . . . . 0.71 111.634 178.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.3 t -78.55 165.98 23.1 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.49 -0.559 . . . . 2.17 109.49 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.1 pttp -58.0 -33.78 69.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.279 0.561 . . . . 3.31 110.373 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.97 -25.92 65.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.438 -0.801 . . . . 2.24 111.015 -179.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -67.81 -45.24 75.3 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.364 -0.606 . . . . 1.73 109.364 176.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.1 mp -63.77 -44.99 91.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.372 -0.831 . . . . 1.56 110.4 177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 30.1 mtpp -56.29 -42.41 77.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 2.31 110.432 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.26 77.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.572 -0.74 . . . . 1.19 111.596 177.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.1 p -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.169 0.433 . . . . 1.84 112.169 -177.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -77.73 -23.67 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.828 0.823 . . . . 0.66 109.598 -177.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.403 ' HG2' HD21 ' A' ' 155' ' ' ASN . 41.7 ttmt -67.19 -39.46 86.39 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.093 -0.958 . . . . 2.26 111.26 177.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 14.1 mm-40 -71.45 -34.32 70.13 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.463 -0.495 . . . . 2.27 110.772 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.8 m -65.78 -33.55 64.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.377 -0.529 . . . . 0.91 109.932 174.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.485 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 62.8 mt -72.18 -33.94 68.06 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.76 -0.459 . . . . 1.75 109.76 174.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.444 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.1 ttpt -56.93 -44.24 82.3 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.891 -0.781 . . . . 1.51 108.891 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 10.6 mp -70.91 -48.52 53.18 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.872 -1.058 . . . . 1.68 111.467 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.66 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 51.0 t80 -71.24 -30.87 66.86 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 119.498 -0.881 . . . . 2.2 111.526 -167.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -66.84 -35.05 79.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.032 0.444 . . . . 2.44 110.793 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -88.58 -10.21 49.54 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.88 0.696 . . . . 1.16 112.88 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.5 mtm -71.15 156.36 39.67 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.837 -0.345 . . . . 1.15 111.692 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 129' ' ' LYS . 46.8 t -53.2 141.15 24.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.001 -0.545 . . . . 1.57 110.155 173.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.37 -48.9 77.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.816 0.341 . . . . 2.21 110.924 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.66 75.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.541 . . . . 1.18 110.815 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . 0.43 ' O ' ' HB3' ' A' ' 81' ' ' ALA . . . -73.13 -44.59 35.0 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.751 -0.659 . . . . 0.35 112.607 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.529 ' HB2' ' CE1' ' A' ' 121' ' ' TYR . 14.1 ptmm? -71.15 -29.08 64.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.989 0.423 . . . . 1.84 110.918 -177.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.37 65.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 1.15 110.985 174.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.408 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 26.4 t70 -67.33 -27.91 67.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.296 0.57 . . . . 0.55 109.702 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.435 ' HA ' HD12 ' A' ' 77' ' ' LEU . 88.4 t80 -61.49 -25.21 67.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.224 -0.898 . . . . 0.49 110.529 174.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.482 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -75.07 -12.48 83.39 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.891 -0.671 . . . . 0.27 113.344 -177.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 66.6 mttt -90.52 -48.23 7.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.434 0.635 . . . . 2.95 110.01 -178.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.8 mp0 -79.8 -31.97 40.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.115 -0.948 . . . . 1.83 110.732 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.657 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 5.9 m-85 -124.75 74.64 64.36 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.786 0.327 . . . . 0.91 110.755 175.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.14 -33.97 23.49 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.954 2.436 . . . . 1.06 112.948 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.401 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 37.3 t80 -73.93 -42.38 60.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.724 0.297 . . . . 2.9 110.718 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.417 HD23 ' HD3' ' A' ' 15' ' ' PRO . 58.2 mt -70.92 -44.27 66.53 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.942 -0.303 . . . . 1.67 110.624 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.482 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -59.36 -39.42 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 1.04 110.148 178.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.2 tttm -46.12 -65.75 0.5 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.315 -0.857 . . . . 3.06 111.456 172.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.19 -18.59 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.391 -0.822 . . . . 0.5 112.883 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.416 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 18.6 m-85 -81.75 -41.99 20.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.103 -0.639 . . . . 0.92 110.933 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -70.32 -39.17 74.92 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.115 0.483 . . . . 2.58 110.6 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.0 t -83.95 161.66 20.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.615 -0.721 . . . . 1.81 109.306 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.67 57.74 3.82 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.626 -0.797 . . . . 1.41 112.678 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.411 ' HZ3' ' HB2' ' A' ' 147' ' ' LYS . 3.1 ttmp? -106.55 -69.18 0.84 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.798 -0.445 . . . . 2.46 109.798 175.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.04 -40.69 87.23 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.057 0.456 . . . . 1.07 109.783 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.485 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.99 -43.52 81.78 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.521 -0.763 . . . . 1.12 110.652 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.02 -38.56 86.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.052 0.453 . . . . 3.27 110.413 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 26.3 t80 -67.52 -34.37 76.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.615 -0.72 . . . . 0.68 111.305 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -89.37 -37.26 14.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.933 0.716 . . . . 1.18 112.933 -174.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . 0.455 ' C ' ' H ' ' A' ' 155' ' ' ASN . . . 112.51 19.75 6.88 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.814 -0.914 . . . . 1.62 110.814 -169.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 75.32 -32.3 0.22 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.646 1.179 . . . . 4.12 112.991 177.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.455 ' H ' ' C ' ' A' ' 153' ' ' GLY . 25.5 t-20 . . . . . 0 C--O 1.247 0.95 0 O-C-N 124.497 1.123 . . . . 4.01 110.294 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 34.2 mtt . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.744 0.306 . . . . 23.66 110.791 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 119.93 90.19 1.21 Allowed Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.269 -0.732 . . . . 22.6 111.269 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 38.3 t -61.63 124.02 19.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.974 0.416 . . . . 21.85 110.651 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 27.9 m -96.5 30.98 2.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.074 -0.512 . . . . 20.32 110.338 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 42.1 m80 61.47 44.32 9.44 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.515 -0.766 . . . . 22.01 110.811 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -126.53 127.55 45.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.348 -0.842 . . . . 18.73 109.309 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -81.75 98.96 8.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.931 0.396 . . . . 16.62 110.405 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 33.5 t60 -128.9 87.01 2.51 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.99 -0.55 . . . . 13.55 109.874 -178.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -87.78 62.09 6.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.167 -0.469 . . . . 12.8 111.516 -175.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 64.3 m80 67.04 -81.4 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.393 -0.821 . . . . 11.87 111.43 178.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.5 m 61.32 49.81 5.15 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.182 0.515 . . . . 7.99 111.494 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 46.5 t -134.8 -50.28 0.77 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.139 -0.482 . . . . 7.5 110.765 178.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 88.28 -14.31 59.64 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.85 -0.691 . . . . 4.74 112.419 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -141.24 25.71 2.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.98 0.419 . . . . 5.19 110.751 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 25.0 ttm -127.27 121.05 30.09 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.128 0.489 . . . . 2.17 110.819 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.629 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 4.7 p90 -77.16 161.31 28.31 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.405 -0.816 . . . . 2.09 110.483 -179.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.518 ' HB3' ' OD1' ' A' ' 5' ' ' ASP . 75.3 tttt -135.62 158.1 45.23 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.043 -0.725 . . . . 3.54 109.043 170.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.656 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 44.3 t80 -49.27 -51.52 33.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.167 0.508 . . . . 2.56 110.288 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.32 -20.34 66.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.245 -0.889 . . . . 4.16 112.405 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.518 ' OD1' ' HB3' ' A' ' 2' ' ' LYS . 2.6 m-20 -88.58 -18.8 27.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.865 0.364 . . . . 2.57 110.971 -175.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.2 mt -72.86 131.25 84.19 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.795 -0.817 . . . . 1.31 108.795 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.573 ' HD2' ' HH ' ' A' ' 99' ' ' TYR . 55.0 Cg_exo -41.33 113.28 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.217 2.611 . . . . 0.7 112.163 177.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -19.65 65.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.798 . . . . 1.23 112.218 -171.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.44 -33.47 76.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.773 0.797 . . . . 1.37 109.372 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.665 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 76.1 t80 -83.81 -37.29 22.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.201 -1.363 . . . . 1.08 111.502 -175.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -66.13 -31.87 72.99 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.798 -0.815 . . . . 2.1 108.798 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -15.29 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.042 -1.435 . . . . 1.02 111.908 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.4 mt -92.28 -33.95 14.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.721 0.296 . . . . 1.49 110.688 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.497 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 70.3 mtm -70.19 142.56 90.09 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 1.65 111.191 -176.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.65 149.13 60.75 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.65 2.234 . . . . 1.12 111.906 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -44.37 -49.39 8.98 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.866 3.044 . . . . 1.3 113.599 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.49 ' O ' HD22 ' A' ' 66' ' ' LEU . 46.5 mt-10 -59.05 -43.25 91.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.688 0.28 . . . . 2.26 111.703 -176.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.83 -7.12 49.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 1.39 111.227 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 14' ' ' MET . 62.2 mtp180 -101.01 -32.54 10.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.85 -0.614 . . . . 2.54 110.189 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.81 -46.31 50.91 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.854 -0.612 . . . . 1.06 111.392 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.622 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 58.0 t80 -56.24 -56.59 19.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.965 -0.561 . . . . 0.73 111.526 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.41 HD13 ' CE1' ' A' ' 100' ' ' TYR . 2.6 mm? -78.66 -7.52 57.75 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.609 1.095 . . . . 1.75 111.984 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -70.97 -32.86 69.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.93 0.395 . . . . 2.56 110.152 164.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -82.67 -49.6 9.62 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.737 -0.665 . . . . 1.84 112.244 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.66 HD21 ' O ' ' A' ' 21' ' ' PHE . 2.9 mm? -52.26 134.15 33.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.382 0.61 . . . . 1.7 111.005 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.1 t -130.01 -69.55 0.67 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.444 -0.798 . . . . 2.16 111.289 -174.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -141.24 -78.07 0.28 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.193 0.442 . . . . 2.39 112.193 -172.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.405 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -62.75 -30.84 78.19 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.157 -0.474 . . . . 1.47 112.594 -174.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.4 ' HB2' HD11 ' A' ' 25' ' ' LEU . 0.7 OUTLIER -66.9 -51.69 52.3 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.636 -0.282 . . . . 2.25 110.898 176.694 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 87.7 mttt -56.87 -27.31 60.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.116 0.484 . . . . 1.89 110.886 176.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 45.3 m -65.2 -26.92 68.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.774 . . . . 1.37 110.717 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.9 p -98.27 -23.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 120.64 -0.424 . . . . 0.85 110.808 -177.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.4 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.0 mm? -54.07 -50.36 66.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.74 -0.209 . . . . 1.65 111.14 171.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 0.0 OUTLIER -64.97 -25.48 67.89 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.726 0.298 . . . . 2.89 111.712 -177.204 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.41 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 9.0 mm-40 -68.97 -39.12 79.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.348 -0.387 . . . . 1.96 110.281 175.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.75 -50.66 42.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.936 -0.574 . . . . 0.98 110.379 178.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.406 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 20.4 m-85 -54.6 -46.45 73.8 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 114.066 1.135 . . . . 1.08 114.066 177.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -84.6 7.86 18.74 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.662 -0.815 . . . . 2.71 111.201 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.27 12.24 32.03 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.087 -0.709 . . . . 1.57 109.087 171.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -97.27 -152.26 28.45 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.209 -0.905 . . . . 1.54 111.242 175.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.74 153.65 95.54 Favored 'Cis proline' 0 C--N 1.344 0.3 0 CA-C-N 119.088 1.444 . . . . 1.99 112.655 -0.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 98.6 m-85 -103.83 140.65 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.86 -0.609 . . . . 1.72 110.095 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -76.58 -15.73 59.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.464 -0.789 . . . . 4.11 110.239 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.94 148.08 25.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.713 -0.676 . . . . 1.53 110.327 -177.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.8 t -68.91 -18.66 64.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.074 -0.512 . . . . 1.72 111.525 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -57.12 -46.35 82.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.902 0.382 . . . . 2.24 110.739 176.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.2 OUTLIER -63.6 -29.74 70.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.038 -0.528 . . . . 2.26 111.367 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.0 t -72.43 -42.1 65.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.722 -0.473 . . . . 1.69 109.722 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.84 -46.36 88.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.776 -0.647 . . . . 1.2 110.205 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.42 -49.51 67.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.182 -0.917 . . . . 1.29 111.673 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.79 82.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.183 0.516 . . . . 1.21 110.788 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.1 mt -69.73 -37.06 76.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 1.13 111.086 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -62.91 -38.74 92.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.915 0.388 . . . . 1.87 111.67 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.154 0.502 . . . . 3.57 110.988 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -77.41 -46.49 22.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.827 -0.624 . . . . 2.01 111.852 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.431 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 68.6 m -146.11 97.01 4.52 Favored Pre-proline 0 C--N 1.315 -0.918 0 N-CA-C 110.108 -0.33 . . . . 1.68 110.108 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 5.7 Cg_endo -47.5 -62.94 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.855 3.036 . . . . 0.84 113.553 -167.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.473 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 11.2 pt-20 -67.14 -25.55 66.24 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.162 -0.926 . . . . 2.45 111.749 -177.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -74.29 -41.67 60.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.529 -0.915 . . . . 2.03 108.529 -177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.9 -23.71 77.75 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 114.596 -1.183 . . . . 0.41 111.639 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.28 -32.51 71.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.804 0.335 . . . . 1.19 110.454 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 67.9 mttm -64.93 -49.85 68.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 2.7 110.766 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.27 -29.9 48.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.925 0.393 . . . . 1.12 110.348 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.79 -61.66 2.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.539 . . . . 1.7 111.002 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.9 mptt -59.78 -37.07 78.06 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.11 0.481 . . . . 4.35 110.596 -174.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.49 HD22 ' O ' ' A' ' 17' ' ' GLU . 3.3 tm? -64.61 -43.7 92.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.123 -0.944 . . . . 2.09 110.278 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.438 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 t60 -78.82 -32.97 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.321 -0.622 . . . . 3.07 109.321 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.51 98.59 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.12 -0.946 . . . . 1.26 111.832 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.473 ' HE3' ' HA ' ' A' ' 66' ' ' LEU . 61.5 mtm -59.83 -51.08 71.27 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.411 0.624 . . . . 1.21 110.06 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.02 -43.58 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 114.786 -1.097 . . . . 0.79 110.687 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.4 mmmt -61.12 -38.84 87.8 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.92 -0.582 . . . . 2.03 111.386 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -63.17 -37.22 86.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.26 0.553 . . . . 1.66 110.801 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.35 -43.37 64.15 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 2.14 110.416 177.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.99 -22.5 27.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.477 0.656 . . . . 1.1 110.245 176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.04 -36.25 72.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.931 0.872 . . . . 1.18 109.851 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.01 -2.08 55.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.301 -1.318 . . . . 1.11 110.27 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.41 HD13 ' OD2' ' A' ' 131' ' ' ASP . 8.5 tp -92.01 137.03 32.7 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 1.34 109.605 -176.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.39 156.66 52.21 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.755 -0.736 . . . . 0.76 111.964 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -44.29 -41.43 13.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.86 3.04 . . . . 1.89 114.235 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -67.43 -50.22 60.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.71 0.291 . . . . 2.52 110.76 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.24 -31.35 58.31 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.258 -0.577 . . . . 1.13 110.297 -176.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -58.35 -45.58 87.92 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.475 -0.784 . . . . 2.52 111.187 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.12 -40.85 96.17 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.899 -0.667 . . . . 0.46 112.177 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.5 t80 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.99 -0.105 . . . . 2.04 111.278 177.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.432 ' O ' HD11 ' A' ' 89' ' ' ILE . . . -55.51 -44.92 77.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.95 0.405 . . . . 1.07 111.657 -175.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 40.6 mt-10 -71.19 -22.26 62.04 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.544 -0.462 . . . . 1.96 110.846 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -79.5 -40.3 30.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.619 -0.264 . . . . 2.74 111.249 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.3 p -61.78 -27.04 68.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.061 0.457 . . . . 0.65 110.3 176.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.432 HD11 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -74.34 -50.51 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.918 -0.583 . . . . 1.79 110.132 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.553 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 42.1 mt-10 -58.23 -53.64 55.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.191 0.441 . . . . 2.82 112.191 -177.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.72 -45.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.276 -0.42 . . . . 1.2 111.218 -174.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.63 -40.88 84.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 1.23 110.872 179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -63.5 -31.05 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.87 -0.605 . . . . 5.02 110.673 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.14 -36.15 89.82 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.782 -0.723 . . . . 0.72 111.896 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 43.9 mm -67.66 -50.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.058 0.456 . . . . 1.23 110.42 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 39.4 pttt -82.12 0.19 41.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.159 -0.473 . . . . 3.16 111.646 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.52 -27.99 60.78 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.127 -0.694 . . . . 1.33 109.127 164.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.514 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 66.6 mtp180 -86.69 -7.61 58.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.679 -0.691 . . . . 3.64 109.579 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.573 ' HH ' ' HD2' ' A' ' 7' ' ' PRO . 9.8 m-85 -81.89 -41.36 21.05 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.349 -0.611 . . . . 1.28 109.349 167.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.669 ' HD2' ' CD1' ' A' ' 100' ' ' TYR . 32.5 m-85 -63.39 -50.11 71.16 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.201 0.524 . . . . 1.78 110.981 178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 17.5 p -66.78 -14.43 62.6 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.321 0.86 . . . . 1.51 113.321 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 94.13 3.43 63.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.689 -0.767 . . . . 1.16 113.184 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.422 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 37.0 m-80 -98.51 68.31 1.83 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.2 -0.296 . . . . 2.22 110.2 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -52.31 119.65 15.47 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.709 -0.678 . . . . 1.75 112.318 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.22 163.38 38.86 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.589 2.859 . . . . 0.71 112.722 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 67.3 p -85.77 173.52 9.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.116 -0.493 . . . . 2.17 109.865 174.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -66.59 -27.83 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.19 -0.67 . . . . 3.31 109.19 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.43 -40.23 93.66 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.286 -0.87 . . . . 2.24 110.782 177.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -59.04 -44.71 91.8 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.876 0.37 . . . . 1.73 110.588 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.66 -46.13 73.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 1.56 110.835 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -55.77 -45.86 78.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.261 0.553 . . . . 2.31 110.101 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -62.07 -43.5 98.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.441 -0.799 . . . . 1.19 111.692 178.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 57.9 p -64.92 -36.2 83.6 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.002 0.371 . . . . 1.84 112.002 -178.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.0 m -78.62 -25.12 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 109.024 -0.732 . . . . 0.66 109.024 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 45.5 mttm -61.53 -45.81 92.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.221 -0.899 . . . . 2.26 111.408 176.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.62 ' O ' HD11 ' A' ' 120' ' ' LEU . 22.3 mm-40 -71.01 -38.7 72.63 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.582 -0.447 . . . . 2.27 110.457 -174.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.9 m -62.85 -38.5 82.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.483 -0.487 . . . . 0.91 110.265 177.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.492 ' O ' ' HD3' ' A' ' 122' ' ' LYS . 41.2 mt -78.49 -26.68 46.05 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.079 -0.388 . . . . 1.75 111.358 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -61.98 -48.54 79.88 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.525 -0.917 . . . . 1.51 108.525 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.62 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -65.78 -43.82 87.62 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.072 -1.422 . . . . 1.68 111.667 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.658 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 47.7 t80 -72.03 -37.52 69.73 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 120.315 -0.554 . . . . 2.2 111.291 -170.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.492 ' HD3' ' O ' ' A' ' 118' ' ' LEU . 5.8 mptp? -59.75 -31.97 70.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.47 . . . . 2.44 111.052 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.44 -5.68 59.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.593 -0.731 . . . . 1.16 112.608 -174.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -77.39 156.69 31.02 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.048 -0.661 . . . . 1.15 110.389 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.7 t -67.23 152.05 46.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.639 -0.504 . . . . 1.57 109.639 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -54.72 -42.42 71.5 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.814 0.34 . . . . 2.21 111.254 -175.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.04 -30.39 71.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 1.18 111.044 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.92 -37.46 50.49 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.217 -0.753 . . . . 0.35 111.217 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -63.08 -45.63 91.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.195 0.521 . . . . 1.84 109.986 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.59 84.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.426 -0.807 . . . . 1.15 111.41 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 134' ' ' LYS . 24.7 t70 -73.84 -30.63 62.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.292 0.567 . . . . 0.55 109.774 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -64.52 -26.07 68.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.008 -0.542 . . . . 0.49 110.228 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.439 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.96 -14.8 79.99 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 114.243 0.457 . . . . 0.27 114.243 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.57 ' HZ2' ' HB3' ' A' ' 134' ' ' LYS . 0.5 OUTLIER -95.53 -34.18 12.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.518 0.659 . . . . 2.95 111.408 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -89.64 -28.73 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.768 -0.651 . . . . 1.83 110.695 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.66 ' HE2' ' CE1' ' A' ' 136' ' ' PHE . 17.2 m-85 -128.9 72.96 81.74 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.296 -0.411 . . . . 0.91 110.168 172.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -61.2 -44.76 22.05 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.832 2.355 . . . . 1.06 112.922 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.51 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 34.8 t80 -66.87 -35.6 80.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 2.9 111.263 -174.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 56.9 mt -74.01 -44.06 55.82 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.614 -0.434 . . . . 1.67 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.439 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -61.15 -32.72 72.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.409 0.623 . . . . 1.04 110.065 176.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.2 tttm -55.18 -70.84 0.09 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.926 -1.034 . . . . 3.06 110.963 171.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.9 m -60.37 -30.29 46.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 112.966 0.728 . . . . 0.5 112.966 -175.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.28 -54.4 14.87 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.248 -0.581 . . . . 0.92 110.657 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -79.22 -19.19 51.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 2.58 112.088 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.1 t -85.48 3.45 40.24 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.992 0.425 . . . . 1.81 110.58 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.4 ' HA2' ' HB2' ' A' ' 149' ' ' ALA . . . 75.54 16.83 80.39 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.803 -0.713 . . . . 1.41 112.804 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -79.45 -62.38 1.71 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.836 0.351 . . . . 2.46 110.112 -178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -70.75 -37.14 73.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.094 -0.503 . . . . 1.07 110.006 176.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.479 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -54.56 -37.45 65.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.284 -0.871 . . . . 1.12 111.82 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -82.8 -23.79 33.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.902 0.382 . . . . 3.27 110.697 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -72.48 -29.16 63.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 0.68 109.823 174.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -86.62 -35.08 19.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.903 -0.589 . . . . 1.18 110.826 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 117.82 -36.75 3.54 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.533 -1.027 . . . . 1.62 110.533 -172.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 70.76 158.13 0.18 Allowed 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.927 0.891 . . . . 4.12 111.513 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.828 -0.606 . . . . 4.01 109.443 -176.994 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 86.6 mmm . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.514 0.197 . . . . 23.66 111.451 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -77.94 65.46 3.24 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.949 -0.644 . . . . 22.6 112.268 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.6 m -96.25 118.51 32.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.989 0.423 . . . . 21.85 110.467 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 27.1 m -69.53 133.34 47.55 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.934 -0.576 . . . . 20.32 109.812 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.36 -42.32 75.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.552 . . . . 22.01 110.788 -177.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -162.65 81.38 0.51 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.886 0.374 . . . . 18.73 110.473 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -127.87 94.84 4.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.304 -0.407 . . . . 16.62 110.836 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -162.23 134.3 5.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.958 -0.756 . . . . 13.55 108.958 172.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -112.93 -84.46 0.59 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.785 -0.366 . . . . 12.8 111.093 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 61.6 174.59 0.12 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.889 0.376 . . . . 11.87 111.083 -173.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.8 m 58.91 45.4 15.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.943 -0.571 . . . . 7.99 110.826 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 66.3 m -74.28 94.15 2.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.167 0.508 . . . . 7.5 111.125 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 95.71 -172.74 30.2 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.954 -0.641 . . . . 4.74 111.727 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -82.21 78.77 8.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.288 0.566 . . . . 5.19 110.201 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.741 ' SD ' ' HD2' ' A' ' 30' ' ' LYS . 44.6 tpp -86.9 107.14 18.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.448 -0.796 . . . . 2.17 110.526 -179.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.606 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 24.1 p90 -78.3 147.27 34.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 2.09 110.855 179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -105.48 136.12 45.63 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.376 -0.601 . . . . 3.54 109.376 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.625 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 33.9 t80 -65.23 -35.27 80.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.85 0.357 . . . . 2.56 110.737 -177.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -73.1 -5.75 41.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.451 -0.34 . . . . 4.16 111.753 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -87.92 -10.93 49.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.401 0.619 . . . . 2.57 109.848 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 68.1 mt -79.31 134.69 58.42 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.499 -0.926 . . . . 1.31 108.499 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -41.78 113.58 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.184 2.589 . . . . 0.7 112.123 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -17.99 65.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.723 -0.671 . . . . 1.23 111.768 -172.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 7.4 m-20 -65.27 -31.21 72.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.936 0.874 . . . . 1.37 109.426 178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.67 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 75.0 t80 -85.06 -28.89 25.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.036 -1.438 . . . . 1.08 110.313 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 14' ' ' MET . 58.7 mtp180 -72.02 -25.05 61.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.84 0.829 . . . . 2.1 108.849 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -71.53 -18.99 62.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.172 -1.376 . . . . 1.02 110.661 174.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 9' ' ' ASP . 72.1 mt -91.39 -48.48 6.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 1.49 111.124 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 11' ' ' ARG . 17.5 ptp -63.23 133.38 95.43 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 120.979 0.419 . . . . 1.65 109.994 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -74.26 163.81 35.61 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.602 2.201 . . . . 1.12 112.385 -175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -43.83 -41.74 11.88 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.93 2.42 . . . . 1.3 112.697 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.7 -34.5 18.87 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.438 -0.801 . . . . 2.26 112.122 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.53 -19.25 19.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.717 0.294 . . . . 1.39 111.25 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HG2' ' SD ' ' A' ' 14' ' ' MET . 19.0 mtm180 -88.46 -42.48 12.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.382 -0.372 . . . . 2.54 111.393 -176.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.54 -40.74 60.25 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 123.242 0.339 . . . . 1.06 111.832 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.616 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 32.5 t80 -61.34 -58.97 6.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 119.005 -0.522 . . . . 0.73 111.332 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.5 mt -73.41 -11.92 60.64 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.814 1.188 . . . . 1.75 112.192 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -39.29 83.79 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.622 -0.51 . . . . 2.56 109.622 164.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -69.96 -50.43 41.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.866 -0.607 . . . . 1.84 111.109 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.633 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -59.32 141.97 53.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.31 0.576 . . . . 1.7 111.289 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -141.26 -83.03 0.21 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.491 -0.777 . . . . 2.16 110.456 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.93 158.73 43.8 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.999 -0.741 . . . . 2.39 108.999 176.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.52 -51.4 3.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.894 -0.67 . . . . 1.47 112.833 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -68.75 -43.89 74.87 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.787 -0.243 . . . . 2.25 111.14 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.741 ' HD2' ' SD ' ' A' ' 0' ' ' MET . 86.0 mttt -61.47 -20.03 62.69 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.0 0.429 . . . . 1.89 111.031 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.3 m -63.74 -39.98 95.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.754 -0.657 . . . . 1.37 110.975 177.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.497 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.7 p -80.85 -27.04 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 116.186 -0.461 . . . . 0.85 110.34 -176.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.57 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.4 mm? -54.49 -56.41 19.11 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.279 -0.419 . . . . 1.65 111.329 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -60.93 -25.23 66.63 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.921 0.341 . . . . 2.89 111.921 -175.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -74.19 -15.4 61.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.969 0.414 . . . . 1.96 111.339 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 82.6 t -90.38 -48.1 14.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.575 0.702 . . . . 0.98 109.317 173.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.624 ' HE2' ' CE1' ' A' ' 37' ' ' PHE . 52.6 m-85 -55.1 -45.09 75.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.637 -1.165 . . . . 1.08 114.018 176.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.12 14.15 5.41 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.952 -0.699 . . . . 2.71 111.557 -176.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.51 -77.25 0.59 Allowed 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.556 -0.747 . . . . 1.57 109.846 173.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.503 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 45.82 -150.72 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.795 -0.716 . . . . 1.54 112.684 -174.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.431 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.3 Cg_endo -91.84 148.99 16.0 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.096 -1.21 . . . . 1.99 111.06 -9.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.503 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 23.4 m-85 -116.79 122.13 43.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.457 0.646 . . . . 1.72 111.067 -171.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.58 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 6.9 ptpp? -88.39 -7.02 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.91 -1.041 . . . . 4.11 109.948 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.548 HD22 ' HG3' ' A' ' 47' ' ' GLU . 8.2 p30 -151.83 162.63 40.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.67 -0.696 . . . . 1.53 109.654 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.9 m -69.38 -32.66 71.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.392 -0.367 . . . . 1.72 111.19 -177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.438 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 46.3 mt-10 -59.59 -38.33 80.94 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.073 -0.512 . . . . 2.24 111.313 -176.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.58 ' OE1' ' HG2' ' A' ' 43' ' ' LYS . 34.0 mt-10 -57.87 -42.76 85.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.955 0.407 . . . . 2.26 111.403 177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -70.99 -37.48 72.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.141 -0.481 . . . . 1.69 110.148 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 69.9 mt -65.98 -42.65 92.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.088 -0.505 . . . . 1.2 110.093 178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.02 75.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.339 -0.846 . . . . 1.29 111.025 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.49 90.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.871 -0.604 . . . . 1.21 110.396 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.431 HD22 HD11 ' A' ' 33' ' ' LEU . 24.9 mt -67.23 -40.76 86.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.135 -0.939 . . . . 1.13 111.174 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.51 -32.68 72.72 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.809 0.338 . . . . 1.87 111.004 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -77.27 -46.8 21.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 3.57 110.596 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.1 mmtt -68.52 -49.46 59.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.024 -0.535 . . . . 2.01 111.858 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 m -147.5 92.26 4.85 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 109.853 -0.425 . . . . 1.68 109.853 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -37.39 -56.75 0.8 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 124.593 3.529 . . . . 0.84 114.096 -172.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.68 -28.89 69.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.409 -0.814 . . . . 2.45 112.148 -175.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 33.8 mt -72.63 -37.9 67.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.755 0.788 . . . . 2.03 109.022 -178.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.27 -36.41 89.6 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 114.526 -1.215 . . . . 0.41 111.229 174.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.578 ' O ' ' HD3' ' A' ' 65' ' ' LYS . . . -61.15 -41.19 96.31 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.348 -0.241 . . . . 1.19 110.348 174.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 42.6 mmtm -50.89 -63.65 1.06 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.261 0.553 . . . . 2.7 110.375 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.2 m -67.49 -27.69 39.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.048 -0.978 . . . . 1.12 111.747 -172.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.15 -45.85 79.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.826 0.346 . . . . 1.7 111.193 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.578 ' HD3' ' O ' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -76.62 -34.88 58.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.742 0.782 . . . . 4.35 109.448 179.184 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.44 -48.11 68.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.593 -1.185 . . . . 2.09 112.047 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -72.93 -25.92 61.21 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.842 -0.799 . . . . 3.07 108.842 -175.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.84 -35.3 80.28 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 114.68 -1.146 . . . . 1.26 111.225 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.402 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 36.4 mtm -62.48 -49.96 73.31 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.139 -0.689 . . . . 1.21 109.139 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 67.4 t -54.22 -48.81 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 114.707 -1.133 . . . . 0.79 110.268 176.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -63.6 -43.08 97.98 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.485 -0.78 . . . . 2.03 112.403 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.5 m -64.88 -30.53 71.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.855 0.359 . . . . 1.66 111.303 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.5 mtmt -77.79 -36.26 50.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.428 -0.351 . . . . 2.14 110.232 176.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.89 -24.83 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.505 0.669 . . . . 1.1 110.319 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.92 70.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.804 0.811 . . . . 1.18 109.798 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.47 -0.63 57.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.562 -1.199 . . . . 1.11 110.709 -179.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.3 tp -94.79 135.48 36.23 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.851 -0.613 . . . . 1.34 109.944 -178.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.44 144.43 48.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.929 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -33.8 -43.3 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 125.067 3.845 . . . . 1.89 115.199 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -64.76 -52.73 55.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.941 0.4 . . . . 2.52 110.591 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.5 -31.55 53.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.41 0.624 . . . . 1.13 109.946 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -57.84 -46.26 85.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.772 -1.104 . . . . 2.52 111.118 176.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.91 -40.2 98.54 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.648 -0.787 . . . . 0.46 111.574 177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -65.3 -46.57 79.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.603 -0.299 . . . . 2.04 110.804 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.35 -46.0 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.039 0.447 . . . . 1.07 111.198 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -60.04 -38.42 82.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.3 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.3 tmtp? -77.61 -46.45 22.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.123 -0.231 . . . . 2.74 110.65 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 p -63.37 -43.05 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.753 0.311 . . . . 0.65 111.165 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -62.03 -40.36 87.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 1.79 110.354 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -66.76 -35.52 80.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.493 -0.321 . . . . 2.82 111.42 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 94.8 mt -63.87 -45.72 96.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.723 0.297 . . . . 1.2 110.513 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.675 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -64.95 -42.44 94.62 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.697 -0.482 . . . . 1.23 109.697 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -59.48 -34.06 72.09 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.556 -0.747 . . . . 5.02 111.265 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.69 -39.55 86.13 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.958 -0.639 . . . . 0.72 112.287 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.446 HD12 ' OG ' ' A' ' 113' ' ' SER . 29.6 mm -66.45 -49.67 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.166 0.508 . . . . 1.23 109.672 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.921 ' HZ2' ' HH ' ' A' ' 100' ' ' TYR . 14.5 ptmm? -83.87 36.01 0.54 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.61 0.719 . . . . 3.16 110.114 175.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.1 -32.92 3.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.949 -1.023 . . . . 1.33 109.842 165.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -88.0 -3.48 58.9 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.137 -0.483 . . . . 3.64 110.315 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.434 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 28.2 m-85 -88.32 -31.23 19.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.16 0.505 . . . . 1.28 109.778 166.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.921 ' HH ' ' HZ2' ' A' ' 96' ' ' LYS . 4.5 m-85 -66.74 -34.57 78.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.722 -0.672 . . . . 1.78 111.765 -176.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 p -73.63 -0.42 15.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.756 -0.657 . . . . 1.51 112.644 -174.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.86 9.48 64.03 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.688 -0.768 . . . . 1.16 111.945 -175.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -105.28 177.3 4.89 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.851 -0.426 . . . . 2.22 109.851 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -141.59 100.65 6.13 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.611 -0.268 . . . . 1.75 111.396 -179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 9.6 Cg_endo -56.96 132.83 54.07 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 121.987 1.791 . . . . 0.71 110.078 167.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -76.03 173.51 11.18 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.313 -0.555 . . . . 2.17 110.157 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 86.0 tttt -60.13 -33.12 71.71 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.767 -0.373 . . . . 3.31 110.366 -175.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -58.32 -40.87 83.2 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.819 -0.628 . . . . 2.24 110.864 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.02 -47.55 84.8 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.124 -0.489 . . . . 1.73 110.544 177.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.7 mp -65.4 -45.98 81.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.715 -0.675 . . . . 1.56 110.713 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 151' ' ' PHE . 59.9 mtpt -55.16 -51.32 66.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.03 0.443 . . . . 2.31 110.481 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.54 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -60.96 -41.26 96.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.543 -0.753 . . . . 1.19 111.2 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.446 ' OG ' HD12 ' A' ' 95' ' ' ILE . 50.4 m -65.13 -43.08 93.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.216 -0.447 . . . . 1.84 112.04 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.461 ' O ' ' HB ' ' A' ' 117' ' ' VAL . 10.2 m -76.15 -29.88 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.596 0.712 . . . . 0.66 109.646 -176.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.4 ptmt -72.47 -26.11 61.68 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.13 -0.941 . . . . 2.26 110.624 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.523 ' O ' HD11 ' A' ' 120' ' ' LEU . 4.8 tt0 -76.83 -33.7 57.93 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 109.262 -0.644 . . . . 2.27 109.262 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 114' ' ' VAL . 93.6 t -58.42 -47.72 87.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.424 0.63 . . . . 0.91 110.198 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.575 ' O ' ' HG3' ' A' ' 122' ' ' LYS . 7.7 mt -69.41 -26.14 64.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.62 -0.718 . . . . 1.75 110.37 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 34.3 ttpt -62.62 -43.99 97.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.677 -0.86 . . . . 1.51 108.677 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.523 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.77 -45.95 66.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.839 -1.073 . . . . 1.68 111.841 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.67 ' HD2' ' CD1' ' A' ' 121' ' ' TYR . 0.0 OUTLIER -71.5 -36.12 70.99 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 118.929 -1.108 . . . . 2.2 111.833 -168.652 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 29.8 mttp -64.39 -30.3 71.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.057 0.456 . . . . 2.44 110.49 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -6.38 58.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 1.16 112.352 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.6 mtm -77.37 158.38 30.13 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.224 -0.591 . . . . 1.15 110.317 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.5 m -65.15 152.11 44.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.338 -0.245 . . . . 1.57 110.338 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -57.18 -42.15 80.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.725 0.298 . . . . 2.21 111.181 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.2 -29.65 70.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 1.18 110.956 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.25 -38.66 53.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.942 -0.572 . . . . 0.35 111.932 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -61.51 -45.54 93.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.474 0.654 . . . . 1.84 109.514 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.18 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.05 -0.977 . . . . 1.15 110.966 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -74.24 -34.35 63.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.047 -0.524 . . . . 0.55 109.669 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.06 -34.03 76.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.722 -0.672 . . . . 0.49 110.098 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.412 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -63.9 -22.3 66.4 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.94 -0.573 . . . . 0.27 113.318 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.513 ' HB2' ' HZ1' ' A' ' 134' ' ' LYS . 10.3 mtmp? -85.81 -19.38 30.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 2.95 111.386 -178.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -105.45 -37.2 6.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 1.83 110.991 -177.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.636 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 77.8 m-85 -129.23 73.58 81.59 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.932 0.396 . . . . 0.91 110.059 175.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.47 -30.78 72.08 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.885 2.39 . . . . 1.06 112.388 -175.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.654 ' HE1' ' CE2' ' A' ' 138' ' ' PHE . 36.2 t80 -69.63 -39.53 77.09 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.439 . . . . 2.9 110.242 -178.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.458 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 71.0 mt -77.62 -44.14 29.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.301 -0.408 . . . . 1.67 110.75 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.412 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.29 -39.03 74.91 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.744 -0.465 . . . . 1.04 109.744 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.559 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.2 tttt -45.62 -71.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.04 -0.982 . . . . 3.06 111.444 171.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -67.06 -25.24 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.489 -0.778 . . . . 0.5 112.706 -172.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.458 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 23.0 m-30 -75.03 -54.52 7.02 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.755 -0.778 . . . . 0.92 110.125 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -64.69 -31.3 72.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 2.58 111.777 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 15.7 m -84.9 0.19 51.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.794 0.33 . . . . 1.81 111.471 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.97 79.06 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.774 -0.727 . . . . 1.41 112.648 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -69.43 -47.33 64.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.94 0.4 . . . . 2.46 110.102 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.95 -30.49 61.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.149 -0.478 . . . . 1.07 110.589 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.417 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -58.58 -39.55 80.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 1.12 111.725 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -79.87 -29.54 40.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.78 -0.368 . . . . 3.27 110.8 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 111' ' ' LYS . 66.7 t80 -66.56 -33.01 74.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.177 0.513 . . . . 0.68 109.656 172.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.485 ' HB2' ' CB ' ' A' ' 115' ' ' LYS . . . -67.74 -25.59 65.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.349 -0.841 . . . . 1.18 111.03 177.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 88.68 15.15 60.23 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.558 -0.746 . . . . 1.62 112.013 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -115.83 165.87 12.6 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.98 -0.129 . . . . 4.12 110.72 -177.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 119.262 -0.399 . . . . 4.01 111.409 168.823 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.905 0.383 . . . . 23.66 110.524 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 147.98 64.1 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.709 -0.757 . . . . 22.6 112.241 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -12' ' ' SER . . . . . 0.416 ' C ' ' HG ' ' A' ' -11' ' ' SER . 19.5 p -71.26 144.11 50.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.555 0.217 . . . . 21.85 110.93 -179.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -11' ' ' SER . . . . . 0.416 ' HG ' ' C ' ' A' ' -12' ' ' SER . 64.9 p 51.74 41.1 28.84 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.509 0.724 . . . . 20.32 111.94 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -70.67 142.07 51.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 22.01 110.21 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -129.56 148.02 51.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.058 0.456 . . . . 18.73 111.667 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -122.69 45.65 2.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.832 0.825 . . . . 16.62 108.994 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 19.7 t-80 -78.44 9.45 3.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.908 -1.042 . . . . 13.55 111.236 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -84.95 -12.45 53.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.874 -0.417 . . . . 12.8 109.874 177.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 67.26 174.03 0.26 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.287 -0.87 . . . . 11.87 111.179 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.5 t 55.91 57.9 4.82 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.465 0.65 . . . . 7.99 110.38 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 10.2 p -78.65 132.06 36.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.861 -0.609 . . . . 7.5 111.032 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 100.4 -122.61 7.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.964 -0.636 . . . . 4.74 111.815 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -134.17 98.25 4.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.055 0.455 . . . . 5.19 110.297 177.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 17.7 ttm -104.76 77.41 1.35 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.959 -0.564 . . . . 2.17 110.175 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.649 ' HD2' ' CD1' ' A' ' 1' ' ' PHE . 3.2 p90 -68.94 156.33 38.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.708 -0.678 . . . . 2.09 109.821 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -105.7 149.45 26.37 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.968 -0.382 . . . . 3.54 109.968 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.654 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 25.3 t80 -54.47 -45.55 73.2 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.921 0.391 . . . . 2.56 111.233 -178.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.54 16.34 1.39 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.477 0.547 . . . . 4.16 112.477 -176.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -86.12 -8.56 57.78 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.647 -0.872 . . . . 2.57 108.647 171.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.8 mt -85.62 129.27 55.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.947 -1.024 . . . . 1.31 109.0 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -42.34 114.77 0.42 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.311 2.674 . . . . 0.7 112.442 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.61 -23.96 65.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.82 -0.627 . . . . 1.23 111.928 -174.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.32 -35.94 82.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.724 0.773 . . . . 1.37 110.022 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.652 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 40.5 t80 -82.16 -20.24 38.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.655 -1.157 . . . . 1.08 110.945 -178.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.667 ' HE ' ' HH ' ' A' ' 3' ' ' TYR . 56.0 mtp180 -72.35 -20.24 61.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.266 -0.642 . . . . 2.1 109.266 176.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -74.71 -23.69 58.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.844 -1.071 . . . . 1.02 109.745 174.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.404 HD12 ' HG2' ' A' ' 147' ' ' LYS . 10.0 mp -83.6 -44.28 14.76 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 114.998 -1.001 . . . . 1.49 110.33 173.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.502 ' SD ' ' HE3' ' A' ' 96' ' ' LYS . 46.4 ttp -68.14 128.7 93.22 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.111 -0.949 . . . . 1.65 111.443 -173.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.89 149.61 89.3 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.142 2.561 . . . . 1.12 112.808 -175.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -51.89 -27.95 29.58 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.096 3.197 . . . . 1.3 113.04 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -64.48 -57.42 9.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.26 0.553 . . . . 2.26 109.584 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 -28.33 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.797 -0.638 . . . . 1.39 110.577 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -68.89 -40.72 79.03 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.8 -0.636 . . . . 2.54 110.758 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.67 -53.1 60.7 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.378 0.511 . . . . 1.06 112.378 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 69.1 t80 -57.21 -41.78 80.1 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.458 0.54 . . . . 0.73 112.458 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.53 HD23 ' HH ' ' A' ' 100' ' ' TYR . 91.6 mt -88.85 -13.79 38.41 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 118.955 0.798 . . . . 1.75 111.402 177.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.45 -42.39 92.4 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.241 -0.652 . . . . 2.56 109.241 164.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -68.1 -53.24 26.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.331 -0.849 . . . . 1.84 111.26 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 21' ' ' PHE . 14.0 mt -56.17 129.91 42.08 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.545 0.688 . . . . 1.7 111.12 -177.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 m -143.47 -83.43 0.16 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.797 -1.092 . . . . 2.16 110.926 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.4 142.87 44.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.522 -0.308 . . . . 2.39 110.651 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.81 -45.1 3.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.946 -0.645 . . . . 1.47 112.959 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -57.02 -47.32 81.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 2.25 110.696 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 mmtm -57.08 -31.21 65.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.833 -0.621 . . . . 1.89 111.35 -174.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -67.8 -32.05 72.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.585 . . . . 1.37 111.473 -178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.482 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 4.7 p -95.18 -28.05 4.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.048 -0.523 . . . . 0.85 111.722 -172.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.412 HD13 ' HE2' ' A' ' 37' ' ' PHE . 4.0 mm? -55.8 -45.95 78.13 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.707 0.262 . . . . 1.65 111.707 175.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -62.15 -30.44 71.05 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.66 0.266 . . . . 2.89 111.303 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -69.51 -37.06 77.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.331 -0.395 . . . . 1.96 110.611 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 86.8 t -71.97 -51.88 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.5 0.666 . . . . 0.98 110.233 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.704 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 24.0 m-85 -59.93 -41.47 91.84 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.068 1.507 . . . . 1.08 115.068 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -80.25 2.18 25.53 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.628 -0.829 . . . . 2.71 111.293 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -98.07 -80.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.708 -0.678 . . . . 1.57 109.623 172.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.475 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.44 -157.98 0.63 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.761 -0.733 . . . . 1.54 112.96 -172.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -93.88 153.29 14.77 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.042 -1.232 . . . . 1.99 111.49 -7.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.475 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 25.7 m-85 -117.41 132.22 56.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.032 -0.531 . . . . 1.72 110.864 -173.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.442 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 22.2 pttp -87.91 -12.71 43.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.481 -0.781 . . . . 4.11 109.907 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.503 HD22 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -159.84 151.79 20.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.617 -0.719 . . . . 1.53 109.532 -179.308 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.8 m -60.1 -22.02 62.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.615 . . . . 1.72 112.037 -174.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.02 -40.24 80.33 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.816 0.341 . . . . 2.24 110.801 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.503 ' HG3' HD22 ' A' ' 44' ' ' ASN . 46.3 mt-10 -64.77 -31.51 72.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 2.26 111.086 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.3 t -75.61 -37.63 59.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 1.69 109.831 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.11 -42.89 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 1.2 109.655 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.06 -49.28 76.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.047 -0.979 . . . . 1.29 111.361 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.85 95.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.848 -0.614 . . . . 1.21 110.669 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.28 -35.41 76.02 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 115.443 -0.799 . . . . 1.13 111.43 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -65.39 -36.61 84.48 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.028 0.442 . . . . 1.87 110.814 175.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -66.75 -50.15 63.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 3.57 110.363 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.482 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 43.0 mmtt -66.55 -55.34 15.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 2.01 111.915 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.6 t -139.92 95.47 8.62 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 110.199 -0.297 . . . . 1.68 110.199 -175.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.16 -58.94 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.922 3.081 . . . . 0.84 113.424 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.35 -29.49 70.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.231 -0.895 . . . . 2.45 112.064 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.83 -40.6 68.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.28 -1.007 . . . . 2.03 108.28 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.99 -31.39 78.42 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.41 111.683 175.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.12 -43.08 68.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.28 -0.267 . . . . 1.19 110.28 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -58.68 -45.16 90.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.255 -0.43 . . . . 2.7 111.323 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.41 -33.3 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.284 . . . . 1.12 111.121 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.03 -52.72 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.657 -0.247 . . . . 1.7 111.152 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -59.52 -36.49 76.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.43 0.633 . . . . 4.35 110.153 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.475 HD11 ' C ' ' A' ' 66' ' ' LEU . 2.4 tm? -66.44 -45.95 78.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.896 -1.047 . . . . 2.09 110.461 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -77.0 -27.62 54.73 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.357 -0.609 . . . . 3.07 109.357 -171.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.91 96.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.223 -0.899 . . . . 1.26 111.461 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 49.6 mtm -59.37 -51.3 70.49 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.712 0.768 . . . . 1.21 109.32 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.6 t -52.41 -48.32 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 CA-C-N 114.121 -1.4 . . . . 0.79 110.474 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.411 ' HB3' ' HE2' ' A' ' 71' ' ' LYS . 9.5 mmmm -61.6 -41.15 97.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.422 -0.808 . . . . 2.03 111.814 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 t -58.7 -40.68 84.32 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.093 0.473 . . . . 1.66 110.787 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.8 mttm -74.01 -41.69 61.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.905 -0.588 . . . . 2.14 110.691 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.431 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 64.2 mt -68.2 -24.5 30.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.379 0.609 . . . . 1.1 110.662 177.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -39.66 71.56 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.667 -0.697 . . . . 1.18 109.969 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.83 -46.52 62.58 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.939 -1.028 . . . . 1.11 109.973 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.444 HD11 ' CG ' ' A' ' 135' ' ' GLN . 7.1 tp -40.62 132.68 2.12 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 114.858 -1.064 . . . . 1.34 112.723 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 159.71 49.34 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.562 -0.745 . . . . 0.76 112.306 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -46.83 -41.12 25.32 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.795 2.997 . . . . 1.89 113.722 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.4 -53.81 46.51 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.266 0.555 . . . . 2.52 110.393 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.546 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -78.02 -29.13 49.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.731 -0.668 . . . . 1.13 111.099 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.431 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 25.8 ttpp -58.01 -42.52 85.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.722 -0.672 . . . . 2.52 110.53 176.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.35 -42.53 98.9 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.732 -0.747 . . . . 0.46 111.676 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.445 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.6 t80 -65.94 -46.06 79.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.445 0.164 . . . . 2.04 110.962 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.019 0.437 . . . . 1.07 111.363 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.93 -23.37 65.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 1.96 111.209 -176.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -85.93 -49.81 7.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.448 -0.342 . . . . 2.74 110.942 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.3 p -62.21 -40.71 97.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.327 -0.397 . . . . 0.65 111.272 -176.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 43.5 mt -62.11 -37.15 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 116.172 -0.467 . . . . 1.79 111.322 179.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -69.59 -36.71 76.48 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.768 -0.373 . . . . 2.82 110.717 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.11 -48.85 86.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.325 0.584 . . . . 1.2 109.801 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.8 68.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.592 -0.731 . . . . 1.23 111.1 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.2 -41.41 99.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 5.02 110.133 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.432 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -67.45 -32.45 79.17 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.059 -0.591 . . . . 0.72 112.409 -177.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mm -61.13 -43.32 96.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.0 0.429 . . . . 1.23 110.911 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.502 ' HE3' ' SD ' ' A' ' 14' ' ' MET . 3.5 mppt? -100.57 15.79 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.002 0.43 . . . . 3.16 110.529 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.704 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -93.34 -31.1 14.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.661 -0.699 . . . . 1.33 109.22 168.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.567 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 14.4 ptm180 -86.36 -1.49 57.58 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.842 -0.617 . . . . 3.64 109.941 173.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -81.16 -26.76 35.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.037 -0.727 . . . . 1.28 109.037 164.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.663 ' HD2' ' CD1' ' A' ' 100' ' ' TYR . 24.0 m-85 -75.18 -48.89 21.37 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.404 0.621 . . . . 1.78 110.353 177.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.567 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 26.7 p -67.43 -15.6 63.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.51 112.906 -173.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.12 32.84 10.13 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.821 -0.704 . . . . 1.16 112.401 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.66 61.71 1.4 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.705 -0.48 . . . . 2.22 109.705 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 104' ' ' GLU . 4.8 mp0 -45.5 119.67 4.53 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-N 115.205 -0.907 . . . . 1.75 111.999 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -67.7 153.63 75.47 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.57 2.18 . . . . 0.71 111.629 175.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.403 HG21 ' H ' ' A' ' 108' ' ' ASP . 9.1 t -93.35 175.71 6.66 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.564 -0.902 . . . . 2.17 108.564 173.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 31.5 mtmt -62.71 -33.8 75.85 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.487 -0.485 . . . . 3.31 110.199 -175.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.403 ' H ' HG21 ' A' ' 106' ' ' THR . 3.4 m-20 -58.95 -38.65 79.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.455 -0.793 . . . . 2.24 111.197 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -61.23 -44.16 97.71 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.023 -0.362 . . . . 1.73 110.023 178.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.403 ' HA ' ' OG ' ' A' ' 113' ' ' SER . 10.3 mp -67.59 -42.66 82.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.753 -0.658 . . . . 1.56 110.749 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.9 mtpm? -55.61 -48.19 75.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.258 0.551 . . . . 2.31 110.325 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.48 93.06 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.31 -0.859 . . . . 1.19 111.412 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.403 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 79.5 p -64.79 -38.38 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.172 0.434 . . . . 1.84 112.172 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.475 ' O ' HD21 ' A' ' 118' ' ' LEU . 13.7 m -77.6 -23.65 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.847 0.832 . . . . 0.66 109.362 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HA ' ' HB3' ' A' ' 152' ' ' ALA . 52.3 tttm -63.96 -41.14 97.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.778 -1.101 . . . . 2.26 110.987 179.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 18.1 mm-40 -72.32 -33.71 67.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.583 -0.447 . . . . 2.27 110.608 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.2 m -68.44 -34.41 65.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.546 -0.462 . . . . 0.91 110.676 177.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.475 HD21 ' O ' ' A' ' 114' ' ' VAL . 3.1 mm? -70.7 -33.24 70.68 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.926 -0.484 . . . . 1.75 109.963 173.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.4 ttpt -60.71 -46.02 91.97 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.146 -0.687 . . . . 1.51 109.146 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.93 -47.82 60.89 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.963 -1.017 . . . . 1.68 111.804 175.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.609 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 70.3 t80 -70.18 -35.82 74.23 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.872 -0.731 . . . . 2.2 111.745 -167.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 75.4 mttt -67.59 -27.32 66.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.884 0.373 . . . . 2.44 111.088 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.96 -7.58 58.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.944 -0.571 . . . . 1.16 112.43 -176.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.546 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 41.2 mtm -75.68 159.25 31.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.433 -0.507 . . . . 1.15 111.047 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 m -63.43 143.33 57.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.359 -0.382 . . . . 1.57 110.66 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -56.32 -46.23 79.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.607 0.241 . . . . 2.21 111.425 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.51 74.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.004 0.431 . . . . 1.18 110.949 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.77 -35.77 58.43 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.683 -0.69 . . . . 0.35 111.761 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -66.71 -42.18 86.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.345 0.593 . . . . 1.84 110.071 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.55 -29.88 68.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 1.15 110.687 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -76.19 -32.33 58.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.227 0.537 . . . . 0.55 109.785 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.408 ' HA ' HD12 ' A' ' 77' ' ' LEU . 86.6 t80 -61.6 -30.91 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.49 109.698 171.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . 0.448 ' O ' ' HB3' ' A' ' 137' ' ' PRO . . . -75.7 0.69 60.59 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.759 -0.655 . . . . 0.27 112.724 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -99.07 -28.99 13.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.581 0.705 . . . . 2.95 109.584 175.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 50.4 mm-40 -97.95 -42.28 7.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.136 -0.938 . . . . 1.83 110.147 -176.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.615 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 65.6 m-85 -135.22 70.59 68.65 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.162 -0.472 . . . . 0.91 110.11 176.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . 0.448 ' HB3' ' O ' ' A' ' 133' ' ' GLY . 36.8 Cg_endo -65.88 -19.84 58.39 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.864 2.376 . . . . 1.06 112.632 -176.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.522 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 23.1 t80 -65.86 -37.82 87.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.378 -0.374 . . . . 2.9 110.564 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.599 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -78.46 -44.71 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.905 -0.405 . . . . 1.67 109.905 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.15 -32.66 66.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.456 0.646 . . . . 1.04 109.961 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.522 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.5 tttt -54.5 -74.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.563 -1.199 . . . . 3.06 111.155 170.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.97 -28.21 43.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 112.944 0.72 . . . . 0.5 112.944 -173.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.599 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 19.7 m-30 -66.32 -55.28 16.73 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.517 -0.473 . . . . 0.92 110.139 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.9 -27.89 60.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.325 -0.852 . . . . 2.58 111.383 -175.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 35.6 t -63.89 -26.95 68.83 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.531 -0.544 . . . . 1.81 109.531 174.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 104.47 -5.02 44.02 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.818 -0.706 . . . . 1.41 112.557 177.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.404 ' HG2' HD12 ' A' ' 13' ' ' LEU . 51.7 tttp -62.74 -56.33 18.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.789 0.328 . . . . 2.46 111.084 -176.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -62.79 -36.49 83.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 1.07 110.632 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -57.0 -51.26 69.97 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.184 -0.462 . . . . 1.12 110.668 175.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 73.0 mmtt -59.95 -42.71 94.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.369 -0.378 . . . . 3.27 111.007 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.653 ' HE2' ' CE1' ' A' ' 151' ' ' PHE . 26.1 t80 -59.95 -35.16 74.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.437 0.637 . . . . 0.68 110.043 177.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.411 ' HB3' ' HA ' ' A' ' 115' ' ' LYS . . . -77.34 -7.99 56.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.565 -0.743 . . . . 1.18 111.891 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 93.51 13.7 54.94 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.895 -0.669 . . . . 1.62 111.771 -176.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 70.28 111.6 0.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.131 0.972 . . . . 4.12 111.4 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.248 -0.882 . . . . 4.01 110.557 178.558 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 109.892 -0.411 . . . . 23.66 109.892 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -141.62 -122.07 1.78 Allowed Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.824 -0.703 . . . . 22.6 111.857 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.1 t 72.63 -60.51 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.523 0.729 . . . . 21.85 110.748 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 23.3 t 55.73 57.64 5.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.435 0.636 . . . . 20.32 110.959 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -119.3 112.41 19.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.959 -0.564 . . . . 22.01 109.98 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -80.82 140.67 35.31 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.144 -0.48 . . . . 18.73 110.484 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -116.75 57.62 0.78 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.927 -0.578 . . . . 16.62 109.926 178.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -72.94 103.74 3.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.788 -0.642 . . . . 13.55 109.71 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -169.28 127.86 0.99 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.121 -1.437 . . . . 12.8 107.121 -172.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -73.89 49.91 0.34 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.011 0.745 . . . . 11.87 113.011 -168.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 34.2 m -156.82 33.19 0.3 Allowed 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.533 -1.284 . . . . 7.99 107.533 173.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.56 ' C ' ' H ' ' A' ' 26' ' ' SER . 22.8 t -121.54 -42.76 2.42 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.464 0.913 . . . . 7.5 113.464 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . 0.735 ' N ' ' H ' ' A' ' 29' ' ' ASP . . . -158.38 -119.35 0.56 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 120.252 -0.975 . . . . 4.74 115.299 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . 0.579 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -142.45 -161.76 1.3 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.977 -1.307 . . . . 5.19 110.344 -174.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' MET . . . . . 0.407 ' SD ' ' N ' ' A' ' 0' ' ' MET . 0.0 OUTLIER -78.37 -26.82 46.74 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.455 -0.943 . . . . 2.17 108.455 174.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.637 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 2.2 p90 -90.21 144.49 25.81 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.49 -0.777 . . . . 2.09 109.628 172.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.413 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 3.3 mmmp? -117.62 -173.43 2.42 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 3.54 109.818 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.631 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 77.5 t80 -69.62 -38.95 77.42 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.584 -0.895 . . . . 2.56 108.584 173.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.413 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 1.7 mp0 -63.59 -26.21 68.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.487 -1.233 . . . . 4.16 111.628 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -78.43 -17.83 55.82 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.898 0.38 . . . . 2.57 110.969 -176.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.78 126.12 78.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 108.412 -0.959 . . . . 1.31 108.412 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -42.12 114.05 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.328 2.685 . . . . 0.7 113.041 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.43 -25.73 62.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.479 -0.782 . . . . 1.23 111.792 -176.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -62.27 -38.73 90.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 122.043 0.925 . . . . 1.37 109.677 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.646 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 47.8 t80 -80.94 -33.8 33.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.117 -1.401 . . . . 1.08 111.238 -178.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -66.48 -22.62 66.19 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.509 0.671 . . . . 2.1 109.235 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -72.85 -10.34 59.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.485 -1.234 . . . . 1.02 111.631 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -100.64 -42.33 6.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.689 0.281 . . . . 1.49 111.55 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.448 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 25.9 ptt? -76.03 144.2 75.26 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.988 0.423 . . . . 1.65 110.962 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.35 156.05 55.12 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.133 2.555 . . . . 1.12 113.623 -172.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -42.41 -47.57 7.28 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.735 2.957 . . . . 1.3 114.262 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.544 ' O ' HD22 ' A' ' 66' ' ' LEU . 1.6 pm0 -56.56 -45.41 81.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.788 0.267 . . . . 2.26 111.687 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.37 -16.04 62.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.191 0.52 . . . . 1.39 110.992 -178.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HE ' ' HH ' ' A' ' 3' ' ' TYR . 32.0 mtp180 -90.98 -32.31 16.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.795 -0.639 . . . . 2.54 110.076 177.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.427 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 18.0 t70 -56.26 -49.32 74.54 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.67 -0.696 . . . . 1.06 111.86 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.652 ' HD2' ' CD1' ' A' ' 21' ' ' PHE . 60.1 t80 -54.45 -57.54 10.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.43 -0.35 . . . . 0.73 111.349 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 1.025 HD22 ' HH ' ' A' ' 100' ' ' TYR . 88.6 mt -78.08 -6.69 55.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 119.06 0.846 . . . . 1.75 112.062 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.427 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 29.9 tt0 -68.66 -34.67 76.09 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.009 0.433 . . . . 2.56 110.077 163.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -77.93 -54.48 6.26 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.176 -0.466 . . . . 1.84 110.954 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.577 HD21 ' O ' ' A' ' 21' ' ' PHE . 3.3 mm? -55.27 132.02 46.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 1.7 110.488 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.56 ' H ' ' C ' ' A' ' -3' ' ' SER . 38.5 m -137.37 -88.0 0.28 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 120.507 -0.477 . . . . 2.16 112.206 -172.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.636 ' C ' ' H ' ' A' ' -2' ' ' GLY . 15.5 p-10 -132.58 119.41 20.45 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.898 0.38 . . . . 2.39 111.096 174.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.62 -46.94 1.07 Allowed Glycine 0 CA--C 1.542 1.765 0 N-CA-C 115.459 0.944 . . . . 1.47 115.459 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.735 ' H ' ' N ' ' A' ' -2' ' ' GLY . 0.3 OUTLIER -95.2 -6.84 40.72 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.206 1.558 . . . . 2.25 115.206 -170.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.807 ' HD3' ' CE1' ' A' ' 1' ' ' PHE . 90.7 mttt -80.59 -15.89 55.49 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.024 -1.102 . . . . 1.89 108.024 171.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -61.2 -31.59 71.36 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.567 -1.197 . . . . 1.37 110.235 175.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.495 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 7.5 p -89.95 -23.98 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 115.983 -0.553 . . . . 0.85 110.594 -178.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 30' ' ' LYS . 3.7 mm? -54.3 -52.41 61.57 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.194 0.198 . . . . 1.65 111.065 170.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -62.11 -29.59 70.44 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.681 0.277 . . . . 2.89 111.235 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.69 -41.89 99.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.04 -0.527 . . . . 1.96 110.348 175.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.7 t -68.42 -49.68 63.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.295 0.569 . . . . 0.98 110.147 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.676 ' CE1' ' HB2' ' A' ' 97' ' ' ALA . 28.0 m-85 -55.4 -49.32 72.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 114.138 1.162 . . . . 1.08 114.138 177.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -77.38 -5.46 49.77 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.937 -0.705 . . . . 2.71 111.262 -174.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -90.02 -76.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.942 -0.572 . . . . 1.57 109.559 169.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.63 -155.34 1.55 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.299 -0.476 . . . . 1.54 112.881 -175.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -98.49 154.65 7.43 Favored 'Cis proline' 0 N--CA 1.454 -0.826 0 CA-C-N 118.472 1.136 . . . . 1.99 111.938 -7.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.8 124.78 50.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.176 0.513 . . . . 1.72 110.71 -175.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -89.79 -13.62 36.28 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.684 -0.858 . . . . 4.11 108.684 171.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.598 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.1 p30 -148.69 149.87 32.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.831 -1.077 . . . . 1.53 108.51 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 t -70.31 -16.28 62.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.004 0.431 . . . . 1.72 110.887 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.598 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 32.3 tt0 -60.13 -36.73 78.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.933 -0.576 . . . . 2.24 110.267 175.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -60.88 -38.85 87.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.212 -0.449 . . . . 2.26 111.051 177.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.5 t -64.97 -41.7 95.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.229 -0.442 . . . . 1.69 110.11 178.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.492 HD12 ' ND1' ' A' ' 67' ' ' HIS . 78.0 mt -66.28 -48.4 81.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.192 -0.458 . . . . 1.2 110.641 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.53 76.44 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.577 -0.738 . . . . 1.29 111.899 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.83 -38.64 82.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.171 0.51 . . . . 1.21 110.738 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.424 HD22 HD11 ' A' ' 33' ' ' LEU . 20.2 mt -72.6 -33.46 66.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.669 -0.696 . . . . 1.13 111.462 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -66.29 -26.38 67.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.031 0.443 . . . . 1.87 110.833 175.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -77.44 -50.21 13.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.759 -0.655 . . . . 3.57 110.532 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 33.7 mmtt -65.38 -59.87 3.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.601 -0.727 . . . . 2.01 111.981 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.6 t -138.51 99.41 8.66 Favored Pre-proline 0 C--N 1.316 -0.869 0 C-N-CA 120.472 -0.491 . . . . 1.68 110.811 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -40.3 -57.95 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.944 3.096 . . . . 0.84 113.176 -172.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -56.59 -35.61 68.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.49 -1.232 . . . . 2.45 111.933 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 53.9 mt -76.11 -41.32 50.61 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 119.575 -0.85 . . . . 2.03 109.23 -174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.58 -35.14 90.68 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.42 -1.263 . . . . 0.41 111.801 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.6 68.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.92 0.39 . . . . 1.19 110.425 174.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 2.7 tppt? -67.22 -47.4 70.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.948 -0.569 . . . . 2.7 110.768 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.4 p -69.65 -26.7 31.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.182 0.515 . . . . 1.12 110.376 176.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -64.56 -52.98 54.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.63 -0.714 . . . . 1.7 110.954 176.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 45.3 pttt -65.7 -30.59 71.3 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.727 -0.842 . . . . 4.35 108.727 -178.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.95 -0.03 12.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 114.391 -1.277 . . . . 2.09 110.389 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.492 ' ND1' HD12 ' A' ' 49' ' ' ILE . 13.5 m80 -113.64 -48.25 2.94 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 115.843 -0.617 . . . . 3.07 110.201 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.55 76.85 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.173 0.434 . . . . 1.26 112.173 -178.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 44.0 mtm -66.63 -47.7 71.76 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.239 0.542 . . . . 1.21 110.433 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.8 t -62.31 -41.85 93.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.424 -0.807 . . . . 0.79 110.161 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.0 mmmm -63.26 -30.78 71.85 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 115.157 -0.929 . . . . 2.03 111.417 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 40.7 t -62.37 -43.31 99.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.289 0.566 . . . . 1.66 110.553 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -69.54 -39.02 77.7 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.343 -0.614 . . . . 2.14 109.343 177.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.515 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 75.1 mt -77.16 -14.37 14.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.652 0.739 . . . . 1.1 111.148 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.74 -34.32 27.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.831 0.824 . . . . 1.18 109.325 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.65 -0.68 57.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.972 -1.467 . . . . 1.11 110.084 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.407 HD13 ' OD2' ' A' ' 131' ' ' ASP . 13.6 tp -91.4 138.39 31.62 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.462 -0.79 . . . . 1.34 109.827 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.08 151.23 27.18 Favored Glycine 0 C--O 1.227 -0.3 0 CA-C-N 115.928 -0.578 . . . . 0.76 112.537 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -43.52 -42.72 11.05 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.921 3.081 . . . . 1.89 114.179 -176.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 0.3 OUTLIER -81.02 -41.89 21.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.592 -0.276 . . . . 2.52 111.417 -177.085 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.22 82.3 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.568 0.699 . . . . 1.13 109.935 178.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.515 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 28.6 ttpp -53.54 -48.22 69.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.596 -1.184 . . . . 2.52 111.389 174.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.7 -39.69 91.6 Favored Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.798 -0.715 . . . . 0.46 112.191 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -67.34 -46.63 72.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.643 0.258 . . . . 2.04 110.869 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.01 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.088 0.471 . . . . 1.07 111.413 -177.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 41.2 mt-10 -65.71 -23.94 66.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.768 -0.651 . . . . 1.96 111.492 -176.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -93.98 -42.72 8.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 116.736 -0.211 . . . . 2.74 111.359 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.3 p -60.38 -45.08 94.8 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.737 0.304 . . . . 0.65 111.037 -177.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.578 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 1.7 mp -56.49 -40.13 66.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 1.79 110.481 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -74.74 -35.08 62.63 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.121 0.415 . . . . 2.82 112.121 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.4 mt -63.84 -48.26 87.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.034 0.445 . . . . 1.2 109.834 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.7 -30.03 70.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.699 -0.682 . . . . 1.23 110.712 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 11.5 ttt85 -70.49 -40.58 73.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.302 -0.863 . . . . 5.02 110.67 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.71 -32.29 83.67 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 121.255 -0.498 . . . . 0.72 112.328 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.7 mm -62.63 -44.53 99.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.275 0.559 . . . . 1.23 110.715 177.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 36.7 mtmm -91.74 8.85 35.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.903 -0.59 . . . . 3.16 110.275 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.676 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . . . -97.02 -33.15 11.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.781 -0.645 . . . . 1.33 109.61 171.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.411 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 13.8 ptp180 -83.51 -3.34 57.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.161 -0.681 . . . . 3.64 109.161 172.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.507 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.112 -0.699 . . . . 1.28 109.112 164.345 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.636 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 26.9 m-85 -70.17 -48.53 56.87 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.033 -0.53 . . . . 1.78 110.97 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.411 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.5 p -62.15 -19.97 63.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.289 -0.869 . . . . 1.51 112.722 -173.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.39 1.72 40.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.695 -0.764 . . . . 1.16 112.208 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -101.41 60.32 0.9 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.648 -0.501 . . . . 2.22 109.648 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -50.77 116.11 6.64 Favored Pre-proline 0 C--O 1.234 0.251 0 O-C-N 123.817 0.698 . . . . 1.75 111.691 -173.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -64.57 157.16 56.81 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 123.49 2.793 . . . . 0.71 113.324 -174.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.407 ' O ' HD11 ' A' ' 110' ' ' LEU . 75.3 p -87.86 178.0 6.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.524 -0.307 . . . . 2.17 110.31 174.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.64 -25.49 65.76 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.126 0.489 . . . . 3.31 109.972 175.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.474 ' HA ' ' HG2' ' A' ' 111' ' ' LYS . 23.3 m-20 -71.11 -30.84 67.03 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.917 -0.583 . . . . 2.24 110.541 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.15 -46.48 80.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.19 0.519 . . . . 1.73 109.802 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.407 HD11 ' O ' ' A' ' 106' ' ' THR . 10.2 mp -64.91 -47.89 76.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.601 -0.727 . . . . 1.56 111.691 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.474 ' HG2' ' HA ' ' A' ' 108' ' ' ASP . 16.0 ptpt -60.89 -38.5 85.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.912 0.387 . . . . 2.31 110.283 -177.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.21 75.27 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.926 -0.579 . . . . 1.19 111.229 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.7 t -55.33 -48.01 74.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.986 -0.552 . . . . 1.84 110.925 178.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.6 m -77.29 -28.04 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.547 0.689 . . . . 0.66 109.534 -176.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 22.2 ttmm -59.11 -44.82 92.01 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.208 -0.905 . . . . 2.26 111.675 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.467 ' O ' HD11 ' A' ' 120' ' ' LEU . 20.3 mt-10 -71.14 -34.32 70.9 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.026 -0.67 . . . . 2.27 111.253 -176.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.1 m -68.89 -22.41 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 C-N-CA 120.365 -0.534 . . . . 0.91 109.728 176.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.437 HD11 ' HA ' ' A' ' 149' ' ' ALA . 22.0 mt -83.44 -36.82 23.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.483 -0.326 . . . . 1.75 110.485 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.62 -39.53 80.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.615 0.722 . . . . 1.51 109.293 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.467 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -73.11 -48.74 33.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.896 -1.047 . . . . 1.68 112.165 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.649 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 0.0 OUTLIER -70.59 -35.52 73.07 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 119.011 -1.075 . . . . 2.2 111.234 -168.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.82 ' HZ2' ' HH ' ' A' ' 121' ' ' TYR . 72.0 mmtt -61.72 -33.12 73.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.006 0.431 . . . . 2.44 110.59 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.09 -1.7 57.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 1.16 112.464 -176.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.56 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 50.8 mtm -74.82 157.81 34.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.333 -0.547 . . . . 1.15 111.076 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.5 m -63.21 149.08 46.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.148 -0.478 . . . . 1.57 110.368 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -59.34 -43.28 92.78 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.543 0.211 . . . . 2.21 111.534 -174.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.41 -25.96 68.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.836 0.35 . . . . 1.18 111.046 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.76 -36.79 31.85 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.801 -0.714 . . . . 0.35 111.608 177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 124' ' ' MET . 97.5 mttt -65.46 -45.57 83.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.449 0.643 . . . . 1.84 110.014 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.31 -41.27 94.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.091 -0.958 . . . . 1.15 111.652 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.407 ' OD2' HD13 ' A' ' 77' ' ' LEU . 38.7 t70 -71.55 -31.47 67.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.059 0.457 . . . . 0.55 109.853 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -61.86 -29.09 69.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.865 -0.607 . . . . 0.49 110.148 173.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.73 -22.15 79.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.98 -0.629 . . . . 0.27 112.737 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -81.87 -35.39 29.35 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.716 0.769 . . . . 2.95 109.867 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 6.5 mm100 -89.86 -36.88 14.82 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.521 -1.218 . . . . 1.83 110.794 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.638 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 48.7 m-85 -130.21 79.27 73.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.022 0.439 . . . . 0.91 110.408 175.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.98 -37.75 32.05 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 123.146 2.564 . . . . 1.06 113.141 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.5 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 41.6 t80 -69.3 -38.05 78.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.814 0.34 . . . . 2.9 110.592 -175.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.3 mt -75.58 -44.02 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.67 110.956 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.51 76.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.988 0.423 . . . . 1.04 109.961 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.5 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 16.9 tppt? -48.1 -69.51 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.212 -0.903 . . . . 3.06 111.532 171.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.8 m -63.57 -27.45 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 115.372 -0.831 . . . . 0.5 112.569 -174.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.616 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 22.7 m-30 -74.79 -54.12 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.065 -0.654 . . . . 0.92 110.263 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.79 -32.45 73.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 2.58 111.941 -176.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.2 t -75.24 -7.9 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.511 -0.313 . . . . 1.81 110.859 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.7 13.17 83.81 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.867 -0.683 . . . . 1.41 111.774 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.37 -56.09 9.73 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.972 0.415 . . . . 2.46 110.525 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.82 70.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.952 -0.567 . . . . 1.07 110.073 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.437 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -61.25 -36.82 81.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.46 -0.791 . . . . 1.12 111.137 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . 0.433 ' HZ2' ' HB2' ' A' ' 150' ' ' LYS . 0.8 OUTLIER -75.06 -32.76 61.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 3.27 110.169 -179.879 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -68.51 -31.33 70.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.92 -0.582 . . . . 0.68 109.901 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.6 -15.85 62.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.961 -0.563 . . . . 1.18 110.851 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 89.65 31.77 10.98 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.839 -0.619 . . . . 1.62 113.101 176.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.456 ' HG3' ' ND2' ' A' ' 155' ' ' ASN . 11.3 pt-20 -160.36 -168.2 2.1 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 117.256 0.528 . . . . 4.12 111.425 176.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.456 ' ND2' ' HG3' ' A' ' 154' ' ' GLU . 50.0 m-80 . . . . . 0 C--O 1.248 1.007 0 C-N-CA 123.568 0.747 . . . . 4.01 110.706 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 14.0 tmm? . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 109.456 -0.572 . . . . 23.66 109.456 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 105.21 104.92 2.98 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.72 -0.753 . . . . 22.6 111.839 -178.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 5.3 p -77.61 -18.5 56.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.088 0.47 . . . . 21.85 110.442 178.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 14.5 m 58.25 30.95 20.22 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.09 -0.959 . . . . 20.32 112.536 170.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -93.31 -20.27 20.55 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.054 -0.259 . . . . 22.01 111.049 -178.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -80.62 81.89 6.77 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.888 -0.412 . . . . 18.73 109.888 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.83 -21.59 60.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.019 -0.734 . . . . 16.62 109.019 177.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -136.78 141.54 42.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.027 -0.988 . . . . 13.55 108.631 172.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 64.31 90.2 0.09 Allowed 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.682 0.614 . . . . 12.8 110.692 -177.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -85.98 -161.39 0.62 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.987 -0.551 . . . . 11.87 110.209 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 14.8 m -60.32 122.67 15.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.763 0.316 . . . . 7.99 111.039 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.8 m -79.64 66.72 5.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.196 0.522 . . . . 7.5 110.303 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 122.39 -147.67 16.97 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-N 115.714 -0.675 . . . . 4.74 111.534 -177.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 62.0 m80 -97.92 115.55 28.36 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.168 -0.308 . . . . 5.19 110.168 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 2.4 mmt -96.57 111.35 23.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.547 0.689 . . . . 2.17 112.08 -178.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.666 ' HE1' ' CE2' ' A' ' 1' ' ' PHE . 13.6 p90 -95.55 154.27 17.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.309 -0.859 . . . . 2.09 109.029 173.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 4.2 mmmp? -129.32 171.72 12.21 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.667 0.27 . . . . 3.54 110.906 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.619 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 87.1 t80 -56.97 -41.32 78.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.508 0.67 . . . . 2.56 109.89 175.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.471 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 2.1 mp0 -64.35 -24.5 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.809 -1.087 . . . . 4.16 111.999 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -82.91 -14.67 53.75 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.561 -0.456 . . . . 2.57 110.649 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.6 mt -82.18 128.9 66.03 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.222 -0.658 . . . . 1.31 109.222 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -42.49 115.18 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.573 2.849 . . . . 0.7 112.763 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -21.67 66.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 1.23 112.112 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.35 -37.07 82.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.792 0.806 . . . . 1.37 109.685 178.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.661 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 43.4 t80 -80.91 -28.76 35.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.396 -1.274 . . . . 1.08 111.127 -177.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.462 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 14.8 mtm180 -69.46 -21.28 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.723 -0.473 . . . . 2.1 109.723 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.449 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 13.3 t70 -65.68 -21.14 66.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.313 -0.858 . . . . 1.02 110.52 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.2 mt -89.41 -12.43 40.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.947 -0.57 . . . . 1.49 110.937 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 68.1 mtm -95.35 129.2 35.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.029 0.442 . . . . 1.65 110.531 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.464 ' HB2' ' OE1' ' A' ' 17' ' ' GLU . 38.3 Cg_endo -66.67 153.02 79.46 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.858 2.372 . . . . 1.12 112.53 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -42.97 -47.14 8.51 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.384 2.723 . . . . 1.3 113.882 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.486 ' O ' HD12 ' A' ' 66' ' ' LEU . 1.6 pm0 -60.81 -45.3 94.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.661 0.267 . . . . 2.26 111.609 -178.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -28.46 69.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 1.39 110.856 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.778 ' HD2' ' HH ' ' A' ' 3' ' ' TYR . 45.3 mtm105 -89.11 -29.03 19.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.924 -0.58 . . . . 2.54 111.132 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 28.4 t70 -56.02 -38.84 71.07 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.419 0.628 . . . . 1.06 111.134 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.633 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 66.2 t80 -57.71 -58.78 6.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.55 -0.75 . . . . 0.73 110.985 174.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.437 HD22 ' CE1' ' A' ' 100' ' ' TYR . 71.0 mt -75.04 -7.82 54.78 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 119.456 1.026 . . . . 1.75 111.941 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 6.3 tp60 -67.57 -41.63 83.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.247 0.546 . . . . 2.56 110.187 162.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -73.8 -52.46 13.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.585 -0.734 . . . . 1.84 110.838 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.641 HD21 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -50.61 121.36 5.69 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.632 1.206 . . . . 1.7 112.737 -177.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.702 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 15.6 m -141.17 -169.43 2.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 112.547 -2.115 . . . . 2.16 107.938 178.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -57.13 144.05 36.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 118.28 0.491 . . . . 2.39 111.026 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.9 -58.18 0.63 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.799 -0.715 . . . . 1.47 112.248 -178.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.498 ' HB3' ' CD1' ' A' ' 59' ' ' LEU . 40.9 m-20 -87.12 -30.95 20.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.571 0.224 . . . . 2.25 111.29 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.702 ' HG3' ' O ' ' A' ' 26' ' ' SER . 3.0 mtpm? -69.75 -17.97 63.48 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.659 -0.651 . . . . 1.89 110.072 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 9.9 m -64.75 -36.24 83.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.894 -1.048 . . . . 1.37 110.823 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.658 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 12.2 p -81.99 -32.02 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 116.183 -0.462 . . . . 0.85 112.147 -174.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -55.08 -42.74 73.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.348 . . . . 1.65 110.062 175.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 34' ' ' LYS . 3.7 ttpm? -63.29 -29.01 70.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.427 0.632 . . . . 2.89 110.341 -178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 31' ' ' THR . 9.8 mm-40 -79.26 -45.33 19.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.232 -0.895 . . . . 1.96 110.769 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.0 m -75.79 -37.0 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 112.276 0.473 . . . . 0.98 112.276 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.604 ' HD1' ' CD2' ' A' ' 37' ' ' PHE . 15.0 m-85 -62.12 -43.97 97.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.812 1.042 . . . . 1.08 113.812 171.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -80.51 -17.48 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.694 -0.803 . . . . 2.71 110.57 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.58 -77.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 1.57 109.904 168.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.78 -147.16 2.37 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 121.058 -0.591 . . . . 1.54 112.558 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -91.22 123.14 4.82 Favored 'Cis proline' 0 N--CA 1.457 -0.654 0 CA-C-N 118.747 1.274 . . . . 1.99 110.541 -12.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.55 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 21.4 m-85 -99.04 116.95 32.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.55 0.69 . . . . 1.72 111.873 -169.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -71.02 -15.88 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.708 -1.133 . . . . 4.11 111.422 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.432 ' OD1' ' HB2' ' A' ' 46' ' ' GLU . 9.1 p30 -147.2 164.45 33.12 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.156 -0.313 . . . . 1.53 110.156 -174.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.466 HG22 ' CD2' ' A' ' 67' ' ' HIS . 9.2 m -73.18 -32.22 64.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 1.72 111.918 -176.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.432 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 50.1 mt-10 -58.36 -41.81 85.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.565 0.222 . . . . 2.24 111.051 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.55 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.3 OUTLIER -61.98 -33.51 74.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.588 -0.278 . . . . 2.26 111.529 176.629 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.4 m -71.69 -40.29 69.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.27 0.557 . . . . 1.69 109.821 177.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.84 -44.86 98.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.34 -0.845 . . . . 1.2 110.266 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.566 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -55.9 -49.24 73.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.368 -0.833 . . . . 1.29 111.255 175.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -53.33 -41.6 65.89 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.987 -0.551 . . . . 1.21 111.017 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -70.54 -40.82 73.19 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.801 -0.636 . . . . 1.13 111.199 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.482 ' HZ2' ' HG3' ' A' ' 64' ' ' GLU . 91.3 mttt -62.89 -33.64 75.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.08 0.4 . . . . 1.87 112.08 -178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 33.4 mmtp -71.91 -28.44 63.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.393 -0.367 . . . . 3.57 111.463 -177.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.658 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -99.02 -50.53 4.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.08 0.466 . . . . 2.01 110.818 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 t -127.42 93.67 40.2 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.697 -0.853 . . . . 1.68 108.697 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.93 -53.31 7.28 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.798 2.998 . . . . 0.84 112.63 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 17.1 tp10 -57.34 -37.68 72.94 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 114.481 -1.236 . . . . 2.45 111.655 177.095 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.498 ' CD1' ' HB3' ' A' ' 29' ' ' ASP . 1.6 tt -70.04 -45.78 66.42 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.246 -1.02 . . . . 2.03 108.246 -174.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.43 84.14 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 114.235 -1.348 . . . . 0.41 111.865 178.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.78 81.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.809 0.338 . . . . 1.19 110.528 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 96.2 mttt -62.72 -53.02 60.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.087 -0.506 . . . . 2.7 110.836 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -67.61 -28.71 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.489 -0.323 . . . . 1.12 111.203 -179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.482 ' HG3' ' HZ2' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -62.04 -60.02 4.22 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 110.096 -0.335 . . . . 1.7 110.096 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.639 ' O ' ' HG3' ' A' ' 69' ' ' MET . 70.8 mmtt -64.14 -36.64 84.69 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.298 0.57 . . . . 4.35 109.827 -176.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.486 HD12 ' O ' ' A' ' 17' ' ' GLU . 15.1 tp -63.24 -38.79 92.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.94 -1.027 . . . . 2.09 110.648 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.466 ' CD2' HG22 ' A' ' 45' ' ' THR . 48.6 t-80 -81.62 -33.34 31.53 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.746 -0.661 . . . . 3.07 109.62 -175.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.69 -36.56 83.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.222 -0.899 . . . . 1.26 111.185 177.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.639 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 26.6 mtm -63.38 -54.15 41.31 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.203 0.525 . . . . 1.21 109.918 176.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.2 t -54.74 -40.77 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.296 -0.866 . . . . 0.79 110.108 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.66 -40.73 92.76 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.77 -1.105 . . . . 2.03 111.207 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.3 m -57.57 -37.69 73.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 1.66 110.721 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.8 mttm -67.45 -46.69 72.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 2.14 110.31 176.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.88 -29.29 42.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.005 0.431 . . . . 1.1 111.698 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.33 -37.47 85.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.487 0.66 . . . . 1.18 109.956 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.61 -1.47 56.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.789 -1.096 . . . . 1.11 111.152 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.433 HD12 ' HA ' ' A' ' 132' ' ' PHE . 8.9 tp -92.85 134.99 34.54 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.169 -0.469 . . . . 1.34 109.857 -176.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.63 149.83 51.58 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.599 -0.81 . . . . 0.76 111.846 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -39.05 -36.33 0.7 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 124.381 3.387 . . . . 1.89 114.452 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.88 -56.03 18.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.335 0.588 . . . . 2.52 109.68 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.94 -29.99 35.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.664 -0.698 . . . . 1.13 110.807 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -61.74 -38.85 89.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.578 -0.737 . . . . 2.52 110.86 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.57 -40.24 95.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.584 -0.817 . . . . 0.46 111.443 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.421 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 32.7 t80 -67.79 -49.88 59.96 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.837 -0.181 . . . . 2.04 111.223 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.97 -51.89 59.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.945 0.403 . . . . 1.07 112.004 -176.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -71.06 -27.7 63.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.335 -0.393 . . . . 1.96 111.359 -175.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.487 ' O ' ' HB3' ' A' ' 90' ' ' GLU . 58.7 tttp -84.08 -39.48 19.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.552 0.215 . . . . 2.74 111.049 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 p -65.24 -46.09 82.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.795 0.331 . . . . 0.65 110.228 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.84 -31.59 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.017 -0.538 . . . . 1.79 110.339 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.487 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 9.3 tp10 -61.91 -47.56 84.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.884 0.374 . . . . 2.82 110.269 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.09 -46.86 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 1.2 110.398 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.407 ' O ' ' HD2' ' A' ' 96' ' ' LYS . . . -64.33 -35.97 82.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.827 -0.624 . . . . 1.23 110.829 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.424 ' HA ' ' CD ' ' A' ' 96' ' ' LYS . 46.1 mtm180 -62.18 -41.46 98.35 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.795 -0.639 . . . . 5.02 110.813 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.529 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -60.82 -33.94 85.08 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.768 -0.729 . . . . 0.72 112.013 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.5 mm -64.0 -43.42 97.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.598 0.237 . . . . 1.23 111.508 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.553 ' HB3' ' HZ3' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -93.48 -9.47 38.31 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 119.916 -0.714 . . . . 3.16 110.753 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.21 78.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.056 0.455 . . . . 1.33 109.891 170.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 12.1 ptm180 -85.23 3.43 39.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 3.64 110.043 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.471 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.2 m-85 -90.42 -45.51 8.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.037 -0.727 . . . . 1.28 109.037 162.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.615 ' HD1' ' CD2' ' A' ' 100' ' ' TYR . 35.2 m-85 -59.63 -34.25 72.55 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 1.78 111.785 -177.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.5 p -71.73 -2.66 18.26 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.404 0.52 . . . . 1.51 112.404 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 92.58 31.64 8.68 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.807 -0.711 . . . . 1.16 112.304 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 44.7 m-80 -130.8 176.23 8.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.53 -0.545 . . . . 2.22 109.53 -178.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 49.8 mt-10 -142.73 106.87 5.43 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 111.654 0.242 . . . . 1.75 111.654 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.4 Cg_endo -59.17 160.29 19.58 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.834 2.356 . . . . 0.71 111.886 173.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 72.2 p -86.1 165.15 16.83 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.127 -0.694 . . . . 2.17 109.127 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 8.7 ptpp? -61.97 -23.72 66.56 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.334 -0.546 . . . . 3.31 109.88 177.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.409 ' HA ' ' HD2' ' A' ' 111' ' ' LYS . 16.4 m-20 -72.27 -32.43 66.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.693 -0.685 . . . . 2.24 110.937 178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -62.98 -41.29 99.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.421 0.629 . . . . 1.73 109.694 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 7.5 mp -66.19 -41.07 90.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.229 -0.896 . . . . 1.56 110.413 177.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 93.5 mttt -54.49 -52.72 61.04 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.959 0.409 . . . . 2.31 109.939 174.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -59.84 -43.34 94.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.611 -0.722 . . . . 1.19 111.143 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.2 t -55.93 -48.84 74.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 1.84 111.667 178.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 5.0 m -80.95 -24.85 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.616 0.722 . . . . 0.66 110.056 -174.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -66.63 -41.5 88.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 2.26 111.333 179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 12.7 mm-40 -71.87 -35.46 69.81 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.57 -0.452 . . . . 2.27 110.706 -178.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 m -65.37 -33.16 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.678 -0.409 . . . . 0.91 110.251 176.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.557 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 85.1 mt -72.78 -34.85 67.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.038 -0.356 . . . . 1.75 110.038 176.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.01 -43.8 95.0 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.148 -0.686 . . . . 1.51 109.148 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -69.83 -48.07 60.36 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.123 -0.944 . . . . 1.68 111.498 174.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 121' ' ' TYR . 37.9 t80 -69.61 -37.92 77.07 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.878 -0.729 . . . . 2.2 111.702 -168.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -61.07 -33.02 72.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.828 0.347 . . . . 2.44 111.097 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -87.36 -8.03 57.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.746 0.647 . . . . 1.16 112.746 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -74.3 159.71 32.06 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.275 -0.57 . . . . 1.15 111.558 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -59.26 145.06 44.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.067 -0.515 . . . . 1.57 110.494 173.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.91 -43.39 98.92 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.275 -0.42 . . . . 2.21 111.999 -174.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.4 -29.74 70.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 1.18 110.656 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.99 -36.27 57.29 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.563 -0.744 . . . . 0.35 111.602 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.603 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 98.9 mttt -63.6 -45.98 87.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.336 0.588 . . . . 1.84 110.061 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.32 74.56 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.443 -0.799 . . . . 1.15 111.431 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -74.21 -31.95 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.601 -0.518 . . . . 0.55 109.601 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.433 ' HA ' HD12 ' A' ' 77' ' ' LEU . 90.9 t80 -60.11 -34.22 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.699 -0.682 . . . . 0.49 109.811 172.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.15 -10.42 78.2 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.27 113.202 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -87.72 -29.34 21.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.351 0.596 . . . . 2.95 110.268 177.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.498 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -100.98 -37.81 8.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.192 -0.913 . . . . 1.83 111.046 -176.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.665 ' HD2' ' CD1' ' A' ' 136' ' ' PHE . 57.9 m-85 -128.05 71.47 78.94 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.907 0.384 . . . . 0.91 110.073 175.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -62.44 -36.66 64.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.045 2.496 . . . . 1.06 112.427 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 1.67 ' HD1' ' CD2' ' A' ' 138' ' ' PHE . 61.7 t80 -64.31 -41.62 96.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.46 -0.336 . . . . 2.9 110.344 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.9 mt -72.02 -44.68 63.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.486 -0.325 . . . . 1.67 110.333 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -57.19 -40.71 77.92 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.95 -0.389 . . . . 1.04 109.95 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 22.6 ttpp -46.25 -71.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.323 -0.853 . . . . 3.06 111.193 172.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.435 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.1 m -62.83 -26.51 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.658 -0.701 . . . . 0.5 112.259 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -74.51 -41.64 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.848 -0.741 . . . . 0.92 110.488 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 37.3 mt-10 -79.68 -31.71 41.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.747 0.308 . . . . 2.58 111.073 -178.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 57.3 m -70.18 -10.76 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 1.81 111.224 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 79.41 14.99 80.78 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.853 -0.689 . . . . 1.41 111.547 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.449 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 54.8 tptt -69.49 -59.9 2.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.805 0.336 . . . . 2.46 110.585 -177.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.28 75.46 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.132 0.491 . . . . 1.07 109.781 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.557 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -59.32 -45.61 90.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.342 -0.845 . . . . 1.12 111.136 178.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -67.47 -39.81 85.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.317 -0.401 . . . . 3.27 110.405 -178.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.66 ' HD1' ' CD2' ' A' ' 151' ' ' PHE . 47.8 t80 -59.81 -39.53 85.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.917 -0.583 . . . . 0.68 110.537 176.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -73.2 -21.13 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.49 . . . . 1.18 111.515 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 84.41 9.67 81.3 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.447 -1.061 . . . . 1.62 110.447 -171.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 65.2 168.08 0.19 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 122.069 0.938 . . . . 4.12 112.527 -175.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 . . . . . 0 C--O 1.248 1.015 0 CA-C-N 114.543 -1.208 . . . . 4.01 110.098 -176.408 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.699 0.285 . . . . 23.66 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 70.63 -166.3 51.57 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.929 -0.653 . . . . 22.6 112.155 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 5.9 p -149.0 -78.93 0.14 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.62 0.248 . . . . 21.85 111.139 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 32.4 t -122.58 -43.05 2.29 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.083 -0.247 . . . . 20.32 111.166 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -68.66 -66.84 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.317 . . . . 22.01 111.16 -176.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -127.41 115.81 19.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.781 0.324 . . . . 18.73 110.746 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -148.34 35.99 0.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.171 0.51 . . . . 16.62 110.49 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -82.58 176.44 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 13.55 109.885 175.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 59.4 m80 58.15 48.81 12.3 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.913 -0.403 . . . . 12.8 109.913 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -77.09 60.23 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.619 0.723 . . . . 11.87 111.298 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 9.0 p -155.18 136.43 13.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.8 -1.091 . . . . 7.99 109.066 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.6 p -49.13 -58.11 5.53 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 123.548 0.53 . . . . 7.5 112.047 -172.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 153.41 -49.81 0.51 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 111.524 -0.63 . . . . 4.74 111.524 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -81.05 69.69 7.71 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.275 -0.639 . . . . 5.19 109.275 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 84.1 mmm -87.88 134.35 33.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.557 -0.747 . . . . 2.17 109.751 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 1.618 ' HE2' ' CE1' ' A' ' 1' ' ' PHE . 11.2 p90 -77.67 146.21 36.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.103 0.478 . . . . 2.09 110.116 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.586 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 10.5 mtmp? -121.62 155.65 34.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.964 -0.562 . . . . 3.54 109.676 177.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.618 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 47.6 m-85 -83.79 -0.16 49.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.07 0.938 . . . . 2.56 109.592 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -84.16 -19.79 33.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.94 -1.482 . . . . 4.16 108.881 170.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.586 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 9.8 m-20 -96.76 -14.58 21.87 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.88 -0.6 . . . . 2.57 110.344 -174.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.08 130.69 71.74 Favored Pre-proline 0 N--CA 1.449 -0.491 0 N-CA-C 108.601 -0.889 . . . . 1.31 108.601 176.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -40.5 106.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.342 2.694 . . . . 0.7 112.533 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.79 -22.3 66.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.574 -0.739 . . . . 1.23 111.474 -174.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -63.91 -29.26 70.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.918 0.866 . . . . 1.37 109.559 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.612 ' HD1' ' CD2' ' A' ' 10' ' ' TYR . 40.4 t80 -91.8 -27.92 17.69 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.178 -1.374 . . . . 1.08 110.723 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.401 ' HD2' ' SD ' ' A' ' 14' ' ' MET . 7.3 mmm180 -68.13 -23.8 64.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.336 0.589 . . . . 2.1 109.544 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.6 -30.12 71.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.989 -1.005 . . . . 1.02 110.587 173.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.6 mt -82.34 -14.94 54.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.961 -0.563 . . . . 1.49 110.246 -177.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.401 ' SD ' ' HD2' ' A' ' 11' ' ' ARG . 66.9 mtt -71.16 130.19 88.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 1.65 110.616 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -63.48 126.62 18.02 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.267 1.978 . . . . 1.12 111.683 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -40.33 -48.78 4.06 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.963 3.109 . . . . 1.3 114.571 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -75.99 -24.17 55.32 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.814 0.301 . . . . 2.26 111.814 -175.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.34 54.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.265 -0.643 . . . . 1.39 109.265 174.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -71.61 -29.71 64.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.221 -0.899 . . . . 2.54 110.242 173.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -49.49 -53.72 21.67 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.849 0.718 . . . . 1.06 110.798 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.625 ' HD1' ' CD2' ' A' ' 21' ' ' PHE . 87.6 t80 -52.88 -62.11 1.86 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.054 -0.521 . . . . 0.73 111.723 178.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.725 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 36.5 mt -69.25 -20.14 63.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 118.856 0.753 . . . . 1.75 111.821 -177.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -64.7 -31.81 73.19 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 119.187 0.903 . . . . 2.56 110.91 166.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.536 ' HB2' ' O ' ' A' ' 21' ' ' PHE . 0.9 OUTLIER -68.11 -47.65 67.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.073 -0.512 . . . . 1.84 112.178 179.505 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HB2' ' HH ' ' A' ' 3' ' ' TYR . 3.2 mm? -59.53 140.54 56.19 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.32 0.581 . . . . 1.7 111.177 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 t -122.53 -68.56 0.88 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.221 -0.9 . . . . 2.16 111.463 -174.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -151.13 -70.51 0.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.016 0.376 . . . . 2.39 112.016 -174.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.36 -27.3 72.96 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.105 -0.569 . . . . 1.47 112.687 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -73.84 -35.66 64.82 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.892 0.377 . . . . 2.25 110.843 178.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.95 -30.06 71.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.006 0.432 . . . . 1.89 110.929 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 44.3 m -56.28 -43.86 79.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.656 -0.702 . . . . 1.37 111.223 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.572 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.0 p -79.12 -28.55 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.957 -0.565 . . . . 0.85 110.39 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.44 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.0 mm? -55.79 -46.72 77.9 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 121.119 0.485 . . . . 1.65 109.799 168.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HG2' ' HE3' ' A' ' 38' ' ' LYS . 37.2 ttmt -57.06 -29.92 63.83 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.326 -0.852 . . . . 2.89 110.665 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -78.92 -34.18 44.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 1.96 111.232 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 78.4 t -71.29 -49.51 47.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.246 0.546 . . . . 0.98 110.478 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.468 ' HE2' ' CD2' ' A' ' 100' ' ' TYR . 35.4 m-85 -57.43 -24.63 56.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.174 0.805 . . . . 1.08 113.174 176.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.442 ' HE3' ' HG2' ' A' ' 34' ' ' LYS . 9.7 mtmp? -101.42 14.68 31.22 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.966 -0.694 . . . . 2.71 110.911 176.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.86 23.33 10.75 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.086 -0.506 . . . . 1.57 110.747 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.64 -149.86 9.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.88 -0.676 . . . . 1.54 111.852 174.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.0 162.94 86.45 Favored 'Cis proline' 0 N--CA 1.462 -0.346 0 CA-C-N 118.827 1.313 . . . . 1.99 112.064 -2.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -119.01 134.06 55.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.955 -0.566 . . . . 1.72 110.217 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -91.39 -6.29 53.13 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.099 -0.955 . . . . 4.11 109.981 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.424 HD22 ' HG3' ' A' ' 47' ' ' GLU . 5.7 p30 -156.15 149.99 25.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.619 -0.719 . . . . 1.53 109.607 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.2 m -61.6 -26.59 68.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.518 -0.765 . . . . 1.72 111.45 -177.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.99 -33.2 75.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 2.24 111.833 -177.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.424 ' HG3' HD22 ' A' ' 44' ' ' ASN . 44.5 mt-10 -63.11 -35.33 79.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 2.26 110.867 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.8 t -69.68 -35.77 75.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.646 -0.501 . . . . 1.69 109.646 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 77.5 mt -66.58 -43.36 90.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.737 -0.665 . . . . 1.2 110.108 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 -50.79 72.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.305 -0.861 . . . . 1.29 111.148 176.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.77 82.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 1.21 110.773 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.8 mt -68.59 -37.56 79.92 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.646 -0.706 . . . . 1.13 111.376 179.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -61.56 -38.96 89.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.003 0.43 . . . . 1.87 110.825 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -69.54 -50.75 41.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 3.57 110.811 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.572 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 12.5 mmtt -66.91 -43.81 82.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.8 -0.636 . . . . 2.01 112.32 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.2 m -149.86 97.17 3.47 Favored Pre-proline 0 C--N 1.315 -0.893 0 O-C-N 122.073 -0.392 . . . . 1.68 110.485 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -40.82 -56.13 1.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.86 3.04 . . . . 0.84 113.276 -171.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.57 -34.54 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.596 -1.184 . . . . 2.45 112.208 -177.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 mt -71.71 -40.54 69.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.698 0.761 . . . . 2.03 109.156 -176.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.62 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.54 -35.08 91.27 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.35 -1.296 . . . . 0.41 111.526 175.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.439 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -69.24 -42.31 75.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.64 0.257 . . . . 1.19 110.34 174.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -55.37 -53.28 58.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.967 -0.561 . . . . 2.7 110.981 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.1 -30.93 45.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 1.12 111.15 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.62 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -62.24 -58.28 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.404 -0.362 . . . . 1.7 110.224 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.574 ' O ' ' HG3' ' A' ' 69' ' ' MET . 85.7 mttt -61.56 -38.79 88.8 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.388 0.614 . . . . 4.35 110.03 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -39.47 93.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.062 -0.972 . . . . 2.09 109.82 -179.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.53 -29.24 46.34 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.77 -0.65 . . . . 3.07 109.292 -175.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.19 -39.82 95.74 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.086 -0.961 . . . . 1.26 111.321 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.574 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 20.2 mtm -64.93 -46.94 79.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.429 -0.582 . . . . 1.21 109.429 177.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.1 t -56.71 -42.61 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 114.912 -1.04 . . . . 0.79 110.289 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -64.17 -38.87 92.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.798 -0.637 . . . . 2.03 110.811 177.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -56.89 -33.3 66.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.196 0.522 . . . . 1.66 110.382 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 69' ' ' MET . 65.4 mmtt -79.38 -49.63 12.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.6 -0.727 . . . . 2.14 110.441 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -69.37 -25.89 30.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.126 0.488 . . . . 1.1 111.514 -176.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -36.11 76.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.712 0.767 . . . . 1.18 109.698 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.47 2.82 52.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.527 -1.215 . . . . 1.11 110.536 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 132' ' ' PHE . 10.9 tp -93.33 134.23 35.75 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.567 -0.742 . . . . 1.34 109.321 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.39 153.57 46.07 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.762 -0.732 . . . . 0.76 111.838 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -43.07 -38.62 7.49 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.85 3.034 . . . . 1.89 113.657 -178.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.06 -54.3 40.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 2.52 110.315 -177.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.403 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -80.84 -28.09 36.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.817 -0.628 . . . . 1.13 110.936 -174.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 41.4 ttmt -55.32 -44.37 75.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.626 -0.715 . . . . 2.52 110.278 176.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.409 ' O ' ' HD3' ' A' ' 87' ' ' LYS . . . -59.98 -42.14 98.19 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.943 -0.646 . . . . 0.46 112.02 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -67.2 -43.87 81.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.742 0.306 . . . . 2.04 110.985 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -45.38 93.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.372 -0.376 . . . . 1.07 111.456 -177.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 33.5 mt-10 -66.42 -23.25 66.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.274 -0.421 . . . . 1.96 111.045 -177.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.409 ' HD3' ' O ' ' A' ' 83' ' ' GLY . 5.7 mptp? -87.68 -48.48 7.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.365 -0.38 . . . . 2.74 111.258 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 10.8 p -61.47 -39.55 91.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.637 0.256 . . . . 0.65 111.069 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -59.98 -45.04 95.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 1.79 110.866 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.2 -36.4 69.19 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.576 0.227 . . . . 2.82 111.323 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 95.0 mt -61.28 -52.2 64.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 1.2 110.362 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.16 77.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 1.23 110.801 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -60.61 -42.5 96.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.036 -0.529 . . . . 5.02 110.89 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.17 -32.58 84.64 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.008 -0.615 . . . . 0.72 111.982 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.8 mm -61.4 -49.27 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.001 0.429 . . . . 1.23 110.55 179.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.401 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.4 mppt? -94.93 21.46 7.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.148 0.499 . . . . 3.16 110.576 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -105.23 -34.91 7.74 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.533 -0.758 . . . . 1.33 109.047 168.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.506 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 6.4 ptp180 -80.75 -15.85 55.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.946 -0.57 . . . . 3.64 109.61 175.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.401 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.7 m-85 -65.26 -35.78 82.1 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.135 -0.691 . . . . 1.28 109.135 166.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.645 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 13.4 m-85 -75.27 -46.36 34.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.582 -0.735 . . . . 1.78 112.019 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 41.6 p -60.23 -21.82 62.28 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.865 0.691 . . . . 1.51 112.865 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.16 29.41 5.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.844 -0.693 . . . . 1.16 111.957 -174.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -132.77 68.86 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.305 -0.628 . . . . 2.22 109.305 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.63 110.68 2.54 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.898 -0.592 . . . . 1.75 111.745 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.426 ' HG3' ' HG3' ' A' ' 98' ' ' ARG . 78.2 Cg_exo -50.78 148.75 15.53 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.8 3.0 . . . . 0.71 113.772 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -88.61 168.76 12.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.788 -0.819 . . . . 2.17 108.788 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.537 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.7 tppt? -59.93 -38.39 82.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.403 0.547 . . . . 3.31 109.783 -176.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.03 -31.16 72.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.972 -1.013 . . . . 2.24 111.258 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -64.15 -44.41 92.2 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.239 0.542 . . . . 1.73 109.837 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.8 mp -68.0 -44.73 75.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 1.56 110.789 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 58.4 mtpt -54.66 -46.55 74.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.392 0.615 . . . . 2.31 110.133 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.74 -43.17 94.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 1.19 111.723 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -64.43 -39.17 93.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.977 0.362 . . . . 1.84 111.977 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 4.3 m -76.74 -27.96 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-O 121.671 0.748 . . . . 0.66 109.292 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -62.13 -37.65 85.96 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.9 . . . . 2.26 111.036 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.428 ' O ' HD11 ' A' ' 120' ' ' LEU . 8.7 tt0 -77.35 -34.55 55.11 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 116.453 -0.34 . . . . 2.27 111.147 -175.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.9 m -62.02 -34.59 64.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.562 -0.455 . . . . 0.91 109.91 171.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.0 mt -72.81 -34.13 66.68 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.281 -0.266 . . . . 1.75 110.281 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -59.85 -42.45 93.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.439 0.638 . . . . 1.51 109.344 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.428 HD11 ' O ' ' A' ' 116' ' ' GLU . 10.5 mp -73.58 -45.12 55.16 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.192 -0.913 . . . . 1.68 111.288 175.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.646 ' HD1' ' CD2' ' A' ' 121' ' ' TYR . 34.6 t80 -72.56 -30.75 64.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.99 -0.684 . . . . 2.2 111.893 -170.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.12 -35.79 81.43 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.006 0.432 . . . . 2.44 110.924 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.98 -4.68 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.896 0.702 . . . . 1.16 112.896 -173.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.403 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 55.3 mtm -75.0 154.41 38.07 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.425 -0.51 . . . . 1.15 110.902 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.8 m -64.02 140.63 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.269 -0.423 . . . . 1.57 110.446 176.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -52.64 -45.75 66.81 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.44 0.533 . . . . 2.21 112.44 -170.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -32.47 70.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 1.18 111.108 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.88 -34.2 53.5 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.484 -0.646 . . . . 0.35 111.484 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -67.37 -44.99 77.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.226 0.536 . . . . 1.84 110.371 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.19 -41.66 89.04 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.144 -0.935 . . . . 1.15 111.363 178.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -71.6 -26.65 62.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.05 -0.977 . . . . 0.55 110.407 -174.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.428 ' HA ' HD12 ' A' ' 77' ' ' LEU . 92.2 t80 -63.01 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.753 -0.658 . . . . 0.49 109.898 172.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -74.84 -5.45 74.85 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 121.045 -0.597 . . . . 0.27 112.92 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -94.41 -37.38 11.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.398 0.618 . . . . 2.95 109.874 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.481 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 75.1 mm-40 -90.79 -33.84 15.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.004 -0.998 . . . . 1.83 110.922 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.663 ' HE1' ' CE2' ' A' ' 136' ' ' PHE . 43.4 m-85 -133.38 72.57 74.85 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 0.91 110.471 174.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.93 -29.52 67.08 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.984 2.456 . . . . 1.06 111.774 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -64.58 -39.3 93.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.465 -0.789 . . . . 2.9 111.029 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.6 mt -81.93 -40.18 22.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.522 -0.308 . . . . 1.67 110.605 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.66 70.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.115 0.483 . . . . 1.04 110.127 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.01 -69.59 0.11 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.373 -0.83 . . . . 3.06 111.088 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 148' ' ' ALA . 0.4 OUTLIER -60.19 -30.71 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.071 -0.968 . . . . 0.5 112.631 -174.504 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 16.3 m-30 -73.65 -47.08 42.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.149 -0.621 . . . . 0.92 110.726 -175.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -74.51 -30.86 61.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.558 -0.292 . . . . 2.58 111.639 -175.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 12.4 p -73.04 -16.35 61.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.09 0.471 . . . . 1.81 110.636 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 93.49 1.45 66.29 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.697 -0.763 . . . . 1.41 112.696 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.39 -45.67 93.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.616 0.246 . . . . 2.46 110.93 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . 0.441 ' HB3' ' CG2' ' A' ' 142' ' ' VAL . . . -66.17 -39.51 89.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.855 0.359 . . . . 1.07 110.132 176.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.66 82.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 1.12 111.485 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -75.19 -35.7 61.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 3.27 111.117 -178.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.425 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 45.6 t80 -67.39 -35.43 79.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.099 0.476 . . . . 0.68 109.889 174.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -72.15 -33.8 68.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.586 -0.733 . . . . 1.18 111.216 178.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 89.12 25.57 28.59 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.619 -0.719 . . . . 1.62 112.758 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.495 ' CG ' ' H ' ' A' ' 155' ' ' ASN . 3.9 pt-20 -105.62 -111.96 0.27 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.546 0.573 . . . . 4.12 112.546 -176.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.495 ' H ' ' CG ' ' A' ' 154' ' ' GLU . 9.0 p30 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 116.003 -0.544 . . . . 4.01 111.268 -174.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 19.1 mmt . . . . . 0 N--CA 1.482 1.154 0 CA-C-O 120.708 0.29 . . . . 23.66 110.611 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 123.8 -25.51 6.15 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.72 -0.752 . . . . 22.6 112.25 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 18.2 p -111.24 30.55 6.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 21.85 111.242 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 26.9 m -67.04 -47.63 70.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.038 0.446 . . . . 20.32 109.843 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 15.5 p80 -95.07 136.05 35.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.959 -0.756 . . . . 22.01 108.959 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 61.97 90.5 0.07 Allowed 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.492 0.495 . . . . 18.73 110.027 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -47.81 117.07 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.591 -0.732 . . . . 16.62 111.808 -176.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -135.58 101.55 4.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.472 -0.785 . . . . 13.55 109.372 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -59.46 -43.31 93.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.476 -0.783 . . . . 12.8 111.911 -173.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -80.85 66.27 6.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.832 0.349 . . . . 11.87 110.907 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 5.8 m -137.23 -67.05 0.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 7.99 110.373 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 16.6 m -124.26 -172.64 2.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.863 -0.608 . . . . 7.5 109.694 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -66.41 98.51 0.39 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.084 -0.579 . . . . 4.74 112.639 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -130.26 82.38 2.06 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.626 -0.509 . . . . 5.19 109.626 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 75.9 mmm -76.58 130.71 38.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.283 0.563 . . . . 2.17 111.514 -176.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.613 ' CD2' ' HD3' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -62.4 128.9 38.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.881 -1.054 . . . . 2.09 110.895 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . 33.8 mmtp -116.61 146.3 42.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.734 -0.666 . . . . 3.54 109.834 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.645 ' HE2' ' CE1' ' A' ' 3' ' ' TYR . 85.9 t80 -74.47 -31.36 62.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 2.56 109.941 -179.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -75.99 -5.51 46.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.687 -0.688 . . . . 4.16 110.439 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 2' ' ' LYS . 20.9 t70 -95.46 -16.51 22.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.002 -0.545 . . . . 2.57 109.904 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.47 ' HB ' ' HD2' ' A' ' 11' ' ' ARG . 65.1 mt -70.31 137.72 86.6 Favored Pre-proline 0 C--O 1.236 0.353 0 N-CA-C 108.961 -0.755 . . . . 1.31 108.961 175.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -42.24 116.2 0.58 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.463 . . . . 0.7 112.111 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.94 -16.75 64.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 1.23 112.045 -173.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.14 -30.39 60.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.835 0.826 . . . . 1.37 109.68 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.635 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 72.7 t80 -82.95 -29.37 29.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.55 -1.205 . . . . 1.08 110.849 -178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.47 ' HD2' ' HB ' ' A' ' 6' ' ' ILE . 45.5 mtp180 -70.8 -17.42 62.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.49 0.662 . . . . 2.1 109.952 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -72.14 -22.88 61.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.872 -1.058 . . . . 1.02 110.612 176.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 85.2 mt -89.35 -12.28 40.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.191 -0.459 . . . . 1.49 111.182 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 66.1 mtt -75.82 124.64 88.7 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.428 -0.351 . . . . 1.65 110.801 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.412 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 54.0 Cg_endo -71.99 153.36 57.86 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.566 2.177 . . . . 1.12 111.558 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -45.49 -53.88 5.04 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.593 2.862 . . . . 1.3 113.59 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.551 ' O ' HD22 ' A' ' 66' ' ' LEU . 44.0 mt-10 -59.87 -38.12 81.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.749 0.309 . . . . 2.26 111.585 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.47 58.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.726 0.298 . . . . 1.39 111.1 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 23.0 mtm180 -73.83 -45.03 53.78 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.161 -0.472 . . . . 2.54 110.409 177.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -47.65 -44.87 27.39 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.112 0.883 . . . . 1.06 111.473 -172.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.657 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 38.5 t80 -59.94 -67.27 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.022 -0.535 . . . . 0.73 111.632 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.906 HD22 ' HH ' ' A' ' 100' ' ' TYR . 24.1 mt -70.61 -11.04 60.68 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.74 1.155 . . . . 1.75 112.493 -177.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.65 -40.79 88.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.257 0.551 . . . . 2.56 109.769 163.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -74.7 -48.25 26.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.346 -0.843 . . . . 1.84 112.041 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.76 140.64 54.66 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.537 0.684 . . . . 1.7 111.852 -179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.2 p -139.94 -169.47 2.74 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.653 -1.158 . . . . 2.16 109.531 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.17 150.71 33.46 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.765 -0.457 . . . . 2.39 109.765 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.51 -53.8 4.38 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.501 -0.857 . . . . 1.47 111.322 -174.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.57 -44.78 81.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.523 0.677 . . . . 2.25 109.525 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.613 ' HD3' ' CD2' ' A' ' 1' ' ' PHE . 89.9 mttt -72.07 -12.58 61.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.321 -0.854 . . . . 1.89 110.664 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -76.46 -43.43 39.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.892 -0.594 . . . . 1.37 109.711 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 5.0 p -79.36 -29.93 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 115.431 -0.804 . . . . 0.85 110.498 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.534 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 23.4 mt -56.18 -42.74 77.58 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.869 0.366 . . . . 1.65 110.768 171.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 39.6 ttmt -54.56 -42.1 70.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.903 -0.59 . . . . 2.89 110.929 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.942 -0.572 . . . . 1.96 111.548 -176.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.86 -52.26 11.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.513 0.673 . . . . 0.98 109.564 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.669 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 47.5 m-85 -58.32 -50.47 73.52 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 115.223 1.564 . . . . 1.08 115.223 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 15.5 ptpt -86.54 18.04 3.53 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.42 -0.912 . . . . 2.71 111.729 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.46 -78.67 0.59 Allowed 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.509 -0.768 . . . . 1.57 109.388 169.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 44.77 -151.37 0.75 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 121.084 -0.579 . . . . 1.54 113.22 -175.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.437 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 9.3 Cg_endo -89.28 147.0 22.42 Favored 'Cis proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.986 -1.256 . . . . 1.99 111.318 -6.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.411 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 36.0 m-85 -118.02 114.05 22.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.775 -0.648 . . . . 1.72 110.566 -175.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.452 ' HG3' HD21 ' A' ' 44' ' ' ASN . 13.4 ptmm? -73.19 -7.21 50.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.407 -0.815 . . . . 4.11 111.239 177.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.452 HD21 ' HG3' ' A' ' 43' ' ' LYS . 8.4 p30 -150.03 161.97 41.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.902 -0.407 . . . . 1.53 109.902 -178.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.9 m -73.51 -28.01 61.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.289 -0.414 . . . . 1.72 110.86 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 38.2 mt-10 -59.51 -40.98 88.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 2.24 111.113 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.411 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.9 mt-10 -62.99 -35.17 79.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.738 0.304 . . . . 2.26 111.145 176.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.4 m -69.93 -40.84 75.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.156 0.503 . . . . 1.69 110.006 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 76.2 mt -65.08 -42.72 95.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 1.2 110.212 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.31 80.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.298 -0.864 . . . . 1.29 111.285 176.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.74 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.433 0.635 . . . . 1.21 110.258 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD22 HD21 ' A' ' 33' ' ' LEU . 36.4 mt -69.86 -36.35 75.43 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.202 -0.908 . . . . 1.13 111.395 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -65.12 -30.24 71.16 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.926 -0.31 . . . . 1.87 111.147 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -75.0 -44.37 48.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.206 0.527 . . . . 3.57 110.402 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.454 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 52.3 mmtt -68.71 -55.95 9.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.711 . . . . 2.01 111.607 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 m -142.54 95.7 6.43 Favored Pre-proline 0 C--N 1.315 -0.93 0 N-CA-C 110.214 -0.291 . . . . 1.68 110.214 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.34 -59.61 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.96 3.107 . . . . 0.84 113.95 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -66.88 -22.07 65.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.49 -0.777 . . . . 2.45 112.286 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 3.4 tt -73.85 -41.53 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.602 -1.258 . . . . 2.03 107.602 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.3 -33.11 86.36 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 114.264 -1.334 . . . . 0.41 111.311 174.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.453 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -65.42 -39.86 92.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.796 0.331 . . . . 1.19 110.272 173.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.455 ' HB3' ' O ' ' A' ' 59' ' ' LEU . 16.5 tppt? -57.0 -57.42 12.64 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.638 -0.71 . . . . 2.7 110.916 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.1 p -63.48 -35.65 73.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.327 -0.397 . . . . 1.12 111.246 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.26 -64.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.228 -0.442 . . . . 1.7 111.458 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HD3' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.55 -32.12 73.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.251 0.548 . . . . 4.35 110.788 -173.016 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.556 ' N ' ' HD3' ' A' ' 65' ' ' LYS . 3.4 tm? -67.29 -46.54 73.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.389 -0.823 . . . . 2.09 110.143 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -24.74 57.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.911 -0.774 . . . . 3.07 108.911 -175.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.67 81.94 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.923 -1.035 . . . . 1.26 111.804 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.487 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 34.6 mtm -65.08 -50.73 65.0 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.321 -0.622 . . . . 1.21 109.321 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 89.0 t -53.7 -43.62 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 114.795 -1.093 . . . . 0.79 110.238 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -60.82 -40.17 91.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.311 -0.859 . . . . 2.03 110.683 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.8 m -63.3 -39.31 94.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.641 0.258 . . . . 1.66 111.048 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' A' ' 69' ' ' MET . 32.9 mmtp -66.64 -43.87 83.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 2.14 110.225 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.469 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 77.9 mt -72.51 -23.44 21.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.242 0.544 . . . . 1.1 111.021 178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.14 -30.44 67.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.584 0.707 . . . . 1.18 110.184 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.85 2.91 56.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.863 -1.062 . . . . 1.11 110.761 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.494 HD11 ' CG ' ' A' ' 135' ' ' GLN . 11.5 tp -95.76 132.67 40.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.715 -0.675 . . . . 1.34 110.378 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.86 151.24 49.56 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.894 -0.67 . . . . 0.76 112.061 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -41.07 -42.83 4.84 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 124.075 3.183 . . . . 1.89 114.312 -176.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -60.53 -51.7 68.32 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.417 0.627 . . . . 2.52 110.305 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.524 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.63 -30.74 32.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.146 -0.934 . . . . 1.13 110.646 -173.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.484 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 27.7 ttpp -59.3 -44.59 92.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 2.52 110.518 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.68 -41.68 90.23 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.683 -0.77 . . . . 0.46 111.436 178.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.12 -48.84 66.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.269 . . . . 2.04 111.225 175.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.28 -45.6 76.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.167 0.508 . . . . 1.07 111.388 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.642 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 38.8 mt-10 -67.83 -43.37 79.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 1.96 110.419 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -66.35 -44.04 84.39 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.731 0.301 . . . . 2.74 111.301 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.2 p -62.77 -41.48 99.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.347 -0.388 . . . . 0.65 110.914 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.646 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 28.8 mt -64.59 -39.77 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 116.376 -0.374 . . . . 1.79 110.843 177.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.642 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.3 mt-10 -52.97 -44.26 67.02 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.969 0.414 . . . . 2.82 110.646 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 48.3 mt -69.55 -44.25 79.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.827 -0.624 . . . . 1.2 110.753 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.95 -22.55 64.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 1.23 111.28 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.646 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 39.2 mtm180 -63.41 -50.25 70.59 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.803 -0.443 . . . . 5.02 109.803 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.96 -35.76 92.41 Favored Glycine 0 N--CA 1.453 -0.219 0 CA-C-N 115.961 -0.563 . . . . 0.72 113.185 -172.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.4 -49.44 83.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.991 0.424 . . . . 1.23 110.664 -178.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.482 ' HB2' ' HZ1' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -94.89 7.02 47.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.373 -0.376 . . . . 3.16 111.033 -179.095 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -86.24 -30.83 22.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.218 -0.66 . . . . 1.33 109.218 167.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 61.1 mtp180 -83.24 -7.72 59.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.749 -0.66 . . . . 3.64 109.404 174.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.47 ' CE1' ' HD2' ' A' ' 105' ' ' PRO . 8.4 m-85 -80.05 -26.13 39.84 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.084 -0.71 . . . . 1.28 109.084 166.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.663 ' HE2' ' CE1' ' A' ' 100' ' ' TYR . 23.1 m-85 -80.14 -49.26 11.95 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.131 -0.486 . . . . 1.78 110.723 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.499 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 55.1 p -63.97 -22.33 66.88 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.756 -0.656 . . . . 1.51 112.501 -174.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.47 11.1 45.71 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.7 -0.762 . . . . 1.16 112.715 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.503 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 58.1 t30 -111.35 66.85 0.63 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.675 -0.491 . . . . 2.22 109.675 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.77 123.21 37.66 Favored Pre-proline 0 N--CA 1.464 0.229 0 CA-C-N 115.259 -0.882 . . . . 1.75 112.35 -172.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.47 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 44.9 Cg_endo -69.48 155.04 67.98 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.985 2.457 . . . . 0.71 111.995 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.444 ' O ' HD11 ' A' ' 110' ' ' LEU . 80.6 p -83.79 173.92 10.88 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.933 -0.395 . . . . 2.17 109.933 176.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -65.08 -27.67 68.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.236 0.541 . . . . 3.31 109.807 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -72.8 -29.58 63.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.877 -0.601 . . . . 2.24 110.225 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.71 -44.1 97.58 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-O 121.292 0.567 . . . . 1.73 109.642 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.444 HD11 ' O ' ' A' ' 106' ' ' THR . 7.0 mp -65.18 -45.13 86.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.328 -0.851 . . . . 1.56 110.939 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -58.38 -42.02 86.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.173 0.511 . . . . 2.31 110.127 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.424 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -63.5 -42.94 98.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.721 -0.672 . . . . 1.19 111.412 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -63.26 -34.98 78.85 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.771 -0.372 . . . . 1.84 111.964 -178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 5.5 m -87.1 -27.3 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.221 0.534 . . . . 0.66 110.537 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 14.6 ptpt -71.07 -30.63 66.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.47 . . . . 2.26 110.973 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.603 ' O ' HD21 ' A' ' 120' ' ' LEU . 21.0 mt-10 -77.5 -36.19 52.8 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 119.839 -0.744 . . . . 2.27 110.63 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.2 m -66.41 -28.15 42.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 120.287 -0.565 . . . . 0.91 109.68 175.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.483 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.3 mt -73.92 -38.97 64.14 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.637 -0.505 . . . . 1.75 109.637 173.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -58.65 -49.2 78.42 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.438 -0.579 . . . . 1.51 109.438 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.603 HD21 ' O ' ' A' ' 116' ' ' GLU . 4.4 mm? -61.43 -46.81 88.54 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.662 -0.699 . . . . 1.68 112.052 173.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -32.12 64.51 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 118.513 -1.275 . . . . 2.2 111.862 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.079 0.466 . . . . 2.44 110.654 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.2 59.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.698 . . . . 1.16 112.577 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.524 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 60.6 mtm -72.71 151.03 42.4 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.662 -0.815 . . . . 1.15 110.042 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.3 p -63.43 150.32 43.9 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 1.57 110.145 173.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -55.55 -43.29 75.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.557 0.218 . . . . 2.21 111.501 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.31 -25.15 66.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.137 -0.483 . . . . 1.18 111.464 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.46 -36.1 24.34 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.87 -0.681 . . . . 0.35 111.646 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.465 ' HE3' ' O ' ' A' ' 124' ' ' MET . 98.5 mttt -63.14 -45.92 89.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.211 0.529 . . . . 1.84 110.502 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . 0.536 ' O ' ' HE3' ' A' ' 134' ' ' LYS . . . -66.89 -33.85 76.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.544 -0.753 . . . . 1.15 111.335 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -74.79 -32.26 61.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.914 0.388 . . . . 0.55 110.049 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.47 -32.36 71.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.968 -0.56 . . . . 0.49 110.088 172.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -67.14 -18.65 69.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.889 -0.596 . . . . 0.27 113.067 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.536 ' HE3' ' O ' ' A' ' 130' ' ' ALA . 23.2 mmtp -82.8 -29.37 29.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.468 0.651 . . . . 2.95 110.065 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.494 ' CG ' HD11 ' A' ' 77' ' ' LEU . 6.2 mm100 -96.23 -40.8 8.99 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.041 -0.981 . . . . 1.83 110.976 -174.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.63 ' HD2' ' CD1' ' A' ' 136' ' ' PHE . 70.5 m-85 -131.18 74.1 79.74 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.984 0.421 . . . . 0.91 109.958 176.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.8 -34.55 72.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.104 2.536 . . . . 1.06 112.621 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.539 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 47.8 t80 -64.58 -34.34 78.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.884 0.373 . . . . 2.9 110.616 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 86.6 mt -78.84 -47.43 16.63 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.845 -0.342 . . . . 1.67 110.375 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.03 -33.62 67.38 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.185 0.516 . . . . 1.04 109.777 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.539 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.8 tttp -51.09 -73.37 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.89 -1.05 . . . . 3.06 111.525 171.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.1 m -72.17 -13.76 16.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.346 -0.843 . . . . 0.5 112.91 -171.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.503 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.2 m-30 -80.21 -44.81 19.1 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.41 -0.516 . . . . 0.92 110.259 175.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.84 -43.05 84.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.861 -0.609 . . . . 2.58 110.386 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.4 m -76.85 156.83 31.9 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.96 -0.755 . . . . 1.81 108.96 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -79.28 48.74 3.43 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.509 -0.853 . . . . 1.41 112.763 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -100.64 -65.87 0.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.123 -0.325 . . . . 2.46 110.123 -178.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.86 -38.38 90.8 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.061 0.458 . . . . 1.07 109.86 178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.483 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -55.55 -44.73 77.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.292 -0.867 . . . . 1.12 110.763 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.05 -38.14 82.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 3.27 110.269 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 1.626 ' HE1' ' CE2' ' A' ' 151' ' ' PHE . 25.8 t80 -58.43 -41.85 85.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 0.68 110.255 177.497 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.99 63.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.741 -0.663 . . . . 1.18 111.769 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 110.46 -11.01 30.76 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.314 -0.714 . . . . 1.62 111.314 -175.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 149' ' ' ALA . 18.6 mt-10 68.52 146.23 0.05 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 122.072 0.939 . . . . 4.12 112.451 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 114.637 -1.165 . . . . 4.01 109.824 -179.365 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 87.2 mtp . . . . . 0 N--CA 1.48 1.044 0 CA-C-O 120.732 0.301 . . . . 23.66 110.261 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -113.38 162.14 12.46 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.089 -0.576 . . . . 22.6 111.89 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 38.7 m -78.41 123.61 27.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.94 0.4 . . . . 21.85 110.57 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 26.8 p -79.03 110.64 14.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.089 -0.505 . . . . 20.32 111.054 -177.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -87.79 -22.5 24.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.361 0.6 . . . . 22.01 109.455 174.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -106.18 104.94 14.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.335 -0.848 . . . . 18.73 109.349 175.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -97.2 82.79 3.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.548 -0.296 . . . . 16.62 111.354 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -156.7 71.45 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.347 0.594 . . . . 13.55 109.745 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 28.5 t-80 -87.85 -49.03 7.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.66 -0.7 . . . . 12.8 110.923 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -138.84 -60.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.627 -0.429 . . . . 11.87 111.701 -176.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.6 t -134.49 123.53 24.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 7.99 111.491 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 34.9 m -88.0 -32.61 18.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.919 -0.582 . . . . 7.5 109.657 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 168.07 35.65 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.594 -0.812 . . . . 4.74 112.962 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -87.47 151.86 22.69 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.667 -0.494 . . . . 5.19 109.667 177.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 8.4 tpt -108.23 138.74 44.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.06 0.457 . . . . 2.17 111.322 -174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -56.38 124.55 18.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.836 -1.075 . . . . 2.09 112.444 -177.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -104.89 135.06 46.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.348 -0.842 . . . . 3.54 109.704 176.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 49.5 t80 -64.35 -39.93 94.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.08 -0.963 . . . . 2.56 112.621 -168.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -93.67 18.59 9.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.18 0.514 . . . . 4.16 111.131 -177.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -98.44 0.87 46.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.951 0.881 . . . . 2.57 109.092 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.9 mt -81.9 131.93 55.66 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.946 -1.025 . . . . 1.31 109.169 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.83 114.79 0.57 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.304 2.67 . . . . 0.7 112.349 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.65 66.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.772 -0.649 . . . . 1.23 111.481 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -65.21 -34.92 79.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.9 0.857 . . . . 1.37 109.697 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 1.612 ' HD2' ' CD1' ' A' ' 10' ' ' TYR . 90.7 t80 -82.81 -33.36 27.25 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.447 -1.252 . . . . 1.08 110.369 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.669 HH12 ' HH ' ' A' ' 3' ' ' TYR . 41.1 mtp85 -64.2 -24.86 67.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.324 0.583 . . . . 2.1 110.26 -178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -63.64 -27.02 68.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.02 110.866 176.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 mt -94.23 -19.25 20.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 1.49 110.971 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.533 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 91.5 mtp -65.73 131.29 94.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 1.65 111.653 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -60.51 137.1 71.71 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.657 2.238 . . . . 1.12 111.363 176.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -52.02 -31.24 43.35 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.618 2.878 . . . . 1.3 112.916 -178.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -62.56 -49.5 75.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.075 0.464 . . . . 2.26 110.541 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.08 65.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 1.39 110.909 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -78.56 -44.38 24.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.786 -0.643 . . . . 2.54 111.307 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 32.2 t70 -51.71 -49.47 62.42 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.46 0.475 . . . . 1.06 112.195 -176.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 1.629 ' HE2' ' CE1' ' A' ' 21' ' ' PHE . 54.1 t80 -55.93 -58.49 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.378 -0.374 . . . . 0.73 111.728 177.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.458 HD22 HD22 ' A' ' 25' ' ' LEU . 80.1 mt -72.55 -13.11 61.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.894 0.77 . . . . 1.75 111.329 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.439 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 51.7 tt0 -65.01 -49.47 70.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.688 0.28 . . . . 2.56 110.957 167.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -86.84 -30.79 21.2 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.992 0.367 . . . . 1.84 111.992 -175.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.468 HD21 ' CE2' ' A' ' 21' ' ' PHE . 14.9 tp -67.54 131.25 45.29 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-O 121.328 0.585 . . . . 1.7 110.407 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.543 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 14.2 t -119.22 168.6 10.73 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.414 -0.812 . . . . 2.16 110.011 -172.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 0.8 OUTLIER -54.66 -44.4 73.25 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.335 0.865 . . . . 2.39 113.335 -169.926 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.83 -38.33 83.1 Favored Glycine 0 N--CA 1.454 -0.156 0 C-N-CA 120.833 -0.699 . . . . 1.47 111.938 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HB3' HD13 ' A' ' 59' ' ' LEU . 49.7 m-20 -79.61 -38.63 33.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.433 0.159 . . . . 2.25 110.626 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.543 ' HG3' ' O ' ' A' ' 26' ' ' SER . 82.1 mttt -54.65 -27.95 43.55 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.152 0.501 . . . . 1.89 110.237 176.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.7 m -59.36 -36.33 75.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.425 -0.807 . . . . 1.37 111.522 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.486 ' CG2' ' HB3' ' A' ' 55' ' ' LYS . 6.1 p -89.22 -24.58 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 116.211 -0.45 . . . . 0.85 110.794 -174.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.54 ' O ' ' HD2' ' A' ' 37' ' ' PHE . 4.3 mm? -50.2 -52.01 39.28 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.345 -0.389 . . . . 1.65 111.318 173.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 46.2 pttt -66.19 -21.22 66.31 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.107 0.41 . . . . 2.89 112.107 -176.253 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -70.71 -27.99 64.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.159 0.504 . . . . 1.96 110.184 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.96 -51.89 16.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.726 . . . . 0.98 109.967 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 1.649 ' HD2' ' CD1' ' A' ' 37' ' ' PHE . 49.7 m-85 -60.71 -45.76 92.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.899 1.444 . . . . 1.08 114.899 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.9 -20.95 60.24 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.012 -0.675 . . . . 2.71 110.504 -177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.23 -76.6 0.13 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.903 -0.59 . . . . 1.57 109.907 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.32 -158.38 0.83 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.077 -0.582 . . . . 1.54 112.693 -176.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -95.03 138.01 5.9 Favored 'Cis proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.184 -1.173 . . . . 1.99 111.175 -9.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 41.7 m-85 -114.27 108.18 16.59 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.56 0.695 . . . . 1.72 110.916 -173.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.45 -8.93 29.33 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.435 -1.257 . . . . 4.11 111.0 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -137.79 163.54 31.11 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.617 -0.883 . . . . 1.53 108.617 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.9 m -85.33 -33.29 22.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.797 0.332 . . . . 1.72 110.379 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.408 ' HA ' HD13 ' A' ' 49' ' ' ILE . 6.1 mp0 -56.61 -34.28 67.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 2.24 111.702 179.343 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.6 OUTLIER -68.57 -38.07 80.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.74 0.305 . . . . 2.26 111.242 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.5 m -66.52 -39.34 88.57 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.507 -0.553 . . . . 1.69 109.507 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.439 HD11 ' HA ' ' A' ' 64' ' ' GLU . 97.0 mt -61.79 -44.66 99.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.254 -0.885 . . . . 1.2 110.108 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.77 -48.69 80.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 1.29 111.861 176.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.48 87.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.304 0.573 . . . . 1.21 110.214 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.46 HD22 HD11 ' A' ' 33' ' ' LEU . 29.0 mt -66.49 -38.06 86.44 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.184 -0.916 . . . . 1.13 111.331 178.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.49 ' HZ2' ' CD ' ' A' ' 64' ' ' GLU . 93.7 mttt -62.27 -39.44 92.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.838 0.351 . . . . 1.87 111.547 177.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -71.24 -44.62 64.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.41 -0.359 . . . . 3.57 111.123 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.486 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 25.3 mmtt -68.73 -48.79 62.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.125 -0.489 . . . . 2.01 111.931 177.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.2 m -145.4 96.9 4.78 Favored Pre-proline 0 C--N 1.313 -1.004 0 O-C-N 122.234 -0.291 . . . . 1.68 110.502 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -41.8 -56.79 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.809 3.006 . . . . 0.84 113.209 -170.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG2' ' HE3' ' A' ' 62' ' ' LYS . 37.0 tt0 -60.21 -35.41 75.36 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.533 -1.212 . . . . 2.45 112.436 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.44 HD13 ' HB3' ' A' ' 29' ' ' ASP . 62.1 mt -69.6 -40.61 76.56 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 119.406 -0.917 . . . . 2.03 109.05 -175.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.73 -38.43 96.18 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 114.311 -1.313 . . . . 0.41 111.691 176.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.9 95.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.745 0.307 . . . . 1.19 110.49 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.464 ' HE3' ' HG2' ' A' ' 58' ' ' GLU . 98.7 mttt -62.45 -58.73 6.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.013 -0.539 . . . . 2.7 110.913 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.88 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 1.12 111.425 -177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.49 ' CD ' ' HZ2' ' A' ' 53' ' ' LYS . 38.3 tt0 -67.0 -57.73 6.3 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 121.011 -0.276 . . . . 1.7 111.016 178.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.478 ' HB3' ' HZ2' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -64.67 -31.19 72.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.619 0.723 . . . . 4.35 109.706 -175.468 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 21' ' ' PHE . 21.5 tp -67.79 -38.15 82.95 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.707 -1.133 . . . . 2.09 110.49 177.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -79.36 -31.65 43.02 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.974 -0.75 . . . . 3.07 108.974 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.42 95.45 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.851 -1.068 . . . . 1.26 111.138 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.463 ' HE3' ' HA ' ' A' ' 66' ' ' LEU . 43.9 mtm -58.79 -55.72 31.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.892 -0.41 . . . . 1.21 109.892 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 95.2 t -50.93 -46.82 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 115.366 -0.834 . . . . 0.79 110.949 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.446 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 12.8 mtpt -66.17 -33.92 76.86 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.662 -0.699 . . . . 2.03 112.308 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.4 t -56.6 -41.56 77.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.086 0.47 . . . . 1.66 110.649 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -69.6 -45.33 68.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.963 -0.562 . . . . 2.14 110.061 177.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -67.94 -25.27 31.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.221 0.534 . . . . 1.1 110.889 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.27 -33.77 73.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.709 0.766 . . . . 1.18 109.939 173.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.01 -1.94 58.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.741 -1.118 . . . . 1.11 110.83 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.9 tp -93.95 137.97 32.58 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.731 -0.668 . . . . 1.34 109.894 -175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.97 149.28 51.46 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.393 -0.67 . . . . 0.76 112.037 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -37.95 -42.85 1.48 Allowed 'Trans proline' 0 N--CA 1.478 0.603 0 C-N-CA 124.666 3.577 . . . . 1.89 114.741 -176.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -70.14 -51.37 31.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.552 0.215 . . . . 2.52 110.683 -177.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.49 -33.46 69.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.711 0.767 . . . . 1.13 109.825 -177.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -57.2 -45.92 83.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.401 -1.272 . . . . 2.52 110.927 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.24 97.93 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.654 -0.784 . . . . 0.46 111.738 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.508 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 6.5 t80 -62.49 -48.02 81.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.359 -0.237 . . . . 2.04 110.359 175.503 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.83 -56.95 14.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.274 . . . . 1.07 111.385 -178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 30.3 mt-10 -62.7 -25.13 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 1.96 111.408 -174.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -86.75 -41.46 14.11 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.641 -0.254 . . . . 2.74 111.05 -179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.8 p -66.75 -39.47 87.92 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.683 -0.235 . . . . 0.65 111.158 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 51.7 mm -58.12 -40.14 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 110.077 -0.342 . . . . 1.79 110.077 176.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 75.5 mm-40 -63.61 -34.49 77.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.11 -0.495 . . . . 2.82 111.246 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 53.2 mt -65.82 -49.6 76.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.777 0.323 . . . . 1.2 110.482 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.92 -36.01 79.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.683 -0.488 . . . . 1.23 109.683 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -56.91 -40.62 76.62 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.468 -0.787 . . . . 5.02 110.763 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.86 -36.47 82.03 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.899 -0.667 . . . . 0.72 112.46 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.4 mm -67.62 -49.59 68.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.256 0.551 . . . . 1.23 110.071 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.7 ptmm? -80.68 2.37 26.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 3.16 111.131 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.66 -26.37 27.83 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.89 -0.782 . . . . 1.33 108.89 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.613 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.1 mtp180 -86.86 -1.56 57.89 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 3.64 109.866 174.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -90.84 -22.11 21.13 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.909 -0.404 . . . . 1.28 109.909 165.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 1.67 ' HE1' ' CE2' ' A' ' 100' ' ' TYR . 30.8 m-85 -84.82 -45.04 12.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.96 0.409 . . . . 1.78 110.731 176.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.568 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 16.7 p -70.17 -20.97 63.1 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.005 0.743 . . . . 1.51 113.005 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 98.28 1.47 58.07 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.762 -0.733 . . . . 1.16 112.789 -174.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.613 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 51.3 m-80 -92.64 56.97 2.8 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 122.706 -0.29 . . . . 2.22 110.732 -178.671 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -43.72 123.21 3.81 Favored Pre-proline 0 N--CA 1.469 0.476 0 O-C-N 124.128 0.893 . . . . 1.75 112.374 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.0 155.52 38.4 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.946 2.431 . . . . 0.71 112.177 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -94.17 177.95 5.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.96 -0.756 . . . . 2.17 108.96 173.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.0 ptpp? -62.77 -31.14 72.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.036 -0.666 . . . . 3.31 110.86 -175.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -61.81 -38.28 87.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.605 -0.271 . . . . 2.24 110.777 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -63.54 -45.0 92.55 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.28 0.562 . . . . 1.73 110.3 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.24 -41.93 84.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.296 -0.865 . . . . 1.56 110.895 -178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 59.1 mtpt -60.98 -41.75 97.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.973 0.416 . . . . 2.31 110.021 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.55 -39.44 93.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.939 -0.573 . . . . 1.19 111.291 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 73.7 p -66.28 -33.6 76.11 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.392 0.515 . . . . 1.84 112.392 -177.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.433 ' CG2' ' HB3' ' A' ' 152' ' ' ALA . 6.2 m -85.85 -25.81 6.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.868 0.842 . . . . 0.66 109.404 -179.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 10.3 ttpt -61.5 -46.11 91.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.589 -1.187 . . . . 2.26 111.405 -178.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.465 ' O ' HD11 ' A' ' 120' ' ' LEU . 28.1 mt-10 -73.01 -33.88 66.03 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.666 -0.414 . . . . 2.27 111.793 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 2.5 m -64.13 -34.67 70.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.235 -0.586 . . . . 0.91 110.457 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' CD2' ' HB3' ' A' ' 149' ' ' ALA . 5.0 mp -76.79 -30.01 56.26 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.281 -0.568 . . . . 1.75 110.471 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.405 ' HA ' HD22 ' A' ' 155' ' ' ASN . 37.8 ttpt -62.07 -38.21 87.92 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.168 -0.679 . . . . 1.51 109.168 178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . 0.465 HD11 ' O ' ' A' ' 116' ' ' GLU . 11.1 mp -76.74 -47.5 21.61 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.234 -0.894 . . . . 1.68 111.925 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 1.669 ' HE2' ' CE1' ' A' ' 121' ' ' TYR . 12.9 t80 -72.76 -39.48 66.76 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.469 -0.493 . . . . 2.2 111.938 -168.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -65.42 -36.66 84.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.368 0.604 . . . . 2.44 110.142 178.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.57 -2.1 24.43 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.7 -1.136 . . . . 1.16 112.99 -176.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 74.0 mtm -78.63 153.05 31.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.494 -0.928 . . . . 1.15 108.494 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -53.43 -79.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.402 0.546 . . . . 1.57 111.083 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.493 ' HA ' ' HG2' ' A' ' 129' ' ' LYS . 24.0 t70 -168.78 -47.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.358 -0.214 . . . . 2.21 110.956 175.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.56 74.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.264 -0.425 . . . . 1.18 110.855 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.18 -40.75 28.45 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.444 -0.798 . . . . 0.35 112.685 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.493 ' HG2' ' HA ' ' A' ' 126' ' ' ASP . 4.5 ptpp? -70.81 -35.96 72.76 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.345 -0.542 . . . . 1.84 110.528 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.94 -23.43 60.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 1.15 110.699 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . 0.476 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 35.6 t70 -78.86 -32.33 45.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.55 109.653 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.39 -28.26 69.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.491 -0.777 . . . . 0.49 109.855 173.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.39 -16.73 69.68 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.27 113.211 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 64.8 mttt -86.34 -40.31 15.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 121.628 0.728 . . . . 2.95 109.643 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.44 -43.45 27.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.753 -1.112 . . . . 1.83 111.281 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' PHE . . . . . 1.664 ' HD1' ' CD2' ' A' ' 136' ' ' PHE . 65.7 m-85 -128.1 77.32 76.89 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.91 110.025 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.36 -36.5 44.71 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.319 2.68 . . . . 1.06 113.333 -172.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' PHE . . . . . 0.56 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 52.3 t80 -62.41 -40.77 97.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 2.9 111.373 -175.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 143' ' ' PHE . 92.2 mt -75.2 -45.6 39.41 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.855 -0.338 . . . . 1.67 110.651 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.88 71.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 1.04 110.291 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.9 tttt -52.42 -72.08 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 3.06 111.175 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.551 ' HB ' ' CB ' ' A' ' 147' ' ' LYS . 2.4 m -64.56 -31.71 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.195 -0.911 . . . . 0.5 113.004 -171.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 139' ' ' LEU . 21.3 m-30 -63.88 -29.05 70.27 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.983 0.421 . . . . 0.92 110.92 -177.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -91.19 -12.19 36.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.499 . . . . 2.58 111.558 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 26.4 t -118.24 46.88 1.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.19 0.519 . . . . 1.81 110.098 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 69.68 -99.6 0.68 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.9 -0.667 . . . . 1.41 111.607 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' LYS . . . . . 0.551 ' CB ' ' HB ' ' A' ' 142' ' ' VAL . 31.2 mmtm 48.12 -95.54 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 113.064 0.764 . . . . 2.46 113.064 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.24 90.38 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.054 0.454 . . . . 1.07 110.395 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ALA . . . . . 0.408 ' HB3' ' CD2' ' A' ' 118' ' ' LEU . . . -64.1 -43.14 96.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 1.12 110.295 176.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -66.26 -35.87 81.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.241 0.543 . . . . 3.27 110.176 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 56.6 t80 -62.29 -38.11 88.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.345 -0.843 . . . . 0.68 110.722 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.433 ' HB3' ' CG2' ' A' ' 114' ' ' VAL . . . -94.01 6.25 49.11 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.734 -0.666 . . . . 1.18 111.985 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 97.15 -66.12 0.91 Allowed Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 109.945 -1.262 . . . . 1.62 109.945 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLU . . . . . 0.608 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 15.5 tt0 179.94 -171.83 0.18 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.509 -1.293 . . . . 4.12 107.509 171.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.608 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 27.8 t-20 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.271 -0.871 . . . . 4.01 109.974 -177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.539 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 18.4 t80 . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 121.52 0.676 . . . . 1.47 112.221 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -123.27 124.18 42.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.662 -0.699 . . . . 3.1499999999999999 109.343 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.412 ' CD1' HD12 ' A' ' 6' ' ' ILE . 56.8 t80 -67.77 -17.61 64.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.276 0.56 . . . . 2.3500000000000001 110.513 -175.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -82.59 -9.02 59.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.404 -0.816 . . . . 4.1600000000000001 110.337 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -97.87 -7.63 29.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.074 -0.512 . . . . 2.5699999999999998 110.799 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.412 HD12 ' CD1' ' A' ' 3' ' ' TYR . 52.5 mt -75.47 135.88 71.95 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.295 -0.632 . . . . 0.68999999999999995 109.295 177.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.96 112.11 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.658 2.239 . . . . 0.59999999999999998 111.508 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.4 -22.21 66.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.56999999999999995 112.005 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.76 -30.88 71.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 122.023 0.916 . . . . 1.3700000000000001 109.533 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -88.81 -26.25 21.79 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.037 -1.438 . . . . 0.80000000000000004 110.736 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -72.96 -19.58 61.21 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.681 0.753 . . . . 1.73 109.5 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -72.03 -23.74 61.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.694 -1.139 . . . . 1.02 110.421 172.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.534 HD21 ' CD ' ' A' ' 147' ' ' LYS . 86.8 mt -94.5 17.69 12.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.852 -0.613 . . . . 0.93000000000000005 112.046 -175.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.454 ' SD ' ' HG2' ' A' ' 19' ' ' ARG . 19.4 ptp -128.08 145.16 54.29 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 120.795 -0.362 . . . . 1.1499999999999999 110.046 177.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 31.9 Cg_exo -59.65 140.33 93.11 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.986 2.457 . . . . 0.90000000000000002 112.316 -176.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.88 -34.18 90.84 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.964 3.11 . . . . 0.95999999999999996 112.692 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.56 -39.38 93.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.619 -0.718 . . . . 1.8300000000000001 110.366 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.22 -4.41 50.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.81999999999999995 110.755 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 31.7 mtm180 -98.45 -38.77 9.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.986 -0.552 . . . . 2.1600000000000001 110.162 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -48.78 -42.74 36.74 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.899 0.75 . . . . 1.0600000000000001 111.275 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -56.76 -54.84 41.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.533 -0.758 . . . . 0.65000000000000002 112.132 175.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.588 HD21 ' OH ' ' A' ' 100' ' ' TYR . 65.5 mt -79.53 -10.71 59.85 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.203 0.91 . . . . 1.1299999999999999 111.266 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.26 -45.72 75.83 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.125 0.488 . . . . 2.0600000000000001 110.795 162.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -88.81 -26.48 21.67 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.752 0.649 . . . . 1.8400000000000001 112.752 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.518 HD23 ' CD2' ' A' ' 22' ' ' LEU . 4.8 tp -77.11 136.59 38.63 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-O 121.209 0.528 . . . . 1.05 110.431 -174.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 4.9 p -120.55 -179.18 3.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.525 -0.761 . . . . 1.78 111.738 -171.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.45 -52.17 48.62 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 2.3900000000000001 112.955 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.87 -42.05 78.21 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 116.226 -0.443 . . . . 0.93000000000000005 113.31 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.669 ' O ' HG12 ' A' ' 32' ' ' VAL . 20.8 m-20 -80.86 -36.16 31.75 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.795 -0.238 . . . . 2.25 111.169 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' HD23 ' A' ' 33' ' ' LEU . 96.8 mttt -55.86 -34.03 65.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.325 0.583 . . . . 1.3100000000000001 110.448 177.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.7 m -55.53 -36.56 66.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.01 -0.996 . . . . 0.80000000000000004 112.145 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -88.34 -21.47 6.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 111.978 0.362 . . . . 0.84999999999999998 111.978 -171.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -52.99 -48.06 67.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.681 0.277 . . . . 0.97999999999999998 111.193 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -64.22 -27.68 69.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.338 -0.392 . . . . 2.4100000000000001 111.184 -175.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -68.52 -37.21 79.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.047 0.451 . . . . 1.96 110.052 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 93.4 t -72.62 -48.97 44.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.71 -0.677 . . . . 0.97999999999999998 110.104 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.618 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 32.3 m-85 -57.0 -52.67 64.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.462 1.282 . . . . 0.82999999999999996 114.462 176.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.63 -20.4 59.92 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.286 -0.566 . . . . 2.1800000000000002 111.574 -171.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.64 -74.93 0.21 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.484 -0.325 . . . . 1.5600000000000001 110.255 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.473 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.89 -157.16 1.19 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 121.017 -0.611 . . . . 1.54 112.968 -176.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -95.95 153.58 10.61 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 CA-C-N 118.536 1.168 . . . . 1.6799999999999999 112.001 -7.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 27.7 m-85 -122.3 120.69 34.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 1.28 111.137 -171.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.61 -8.16 54.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.149 -0.932 . . . . 3.5099999999999998 110.554 175.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -160.19 163.81 33.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.018 -0.734 . . . . 1.52 109.018 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.3 m -77.8 -22.77 49.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.776 -0.193 . . . . 1.1799999999999999 111.509 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.83 -36.0 77.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 2.2400000000000002 110.421 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 14.6 mm-40 -57.71 -40.85 80.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.136 0.493 . . . . 2.2599999999999998 110.787 173.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.3 t -70.97 -36.05 72.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.772 -0.649 . . . . 1.1899999999999999 109.846 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.76 -44.87 98.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.286 0.565 . . . . 0.55000000000000004 109.745 176.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.56 -48.7 80.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.021 -0.991 . . . . 0.56999999999999995 111.159 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.55 -40.65 87.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.324 0.583 . . . . 0.5 110.273 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 33' ' ' LEU . 36.5 mt -67.65 -38.24 83.52 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.307 -0.861 . . . . 0.45000000000000001 111.057 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -31.11 72.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.086 0.469 . . . . 1.22 110.995 177.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -75.15 -46.8 31.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 3.0499999999999998 110.946 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -82.79 -37.41 24.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.178 -0.465 . . . . 1.48 112.237 -175.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.7 t -144.49 87.95 7.42 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 109.472 -0.566 . . . . 1.1599999999999999 109.472 176.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -41.42 -60.55 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 124.201 3.268 . . . . 0.57999999999999996 113.9 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.55 -34.53 74.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.117 -0.947 . . . . 2.4500000000000002 111.969 -178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.423 HD22 ' HB3' ' A' ' 29' ' ' ASP . 39.2 tp -68.94 -36.81 78.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.061 -0.718 . . . . 1.4199999999999999 109.061 -175.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.51 -35.34 91.92 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 114.664 -1.153 . . . . 0.37 111.668 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.99 -35.8 69.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.116 0.484 . . . . 0.47999999999999998 110.384 175.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -64.2 -44.26 92.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 2.1699999999999999 111.08 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.5 m -74.71 -30.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.944 -0.302 . . . . 1.1200000000000001 110.765 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.67 -58.89 6.6 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.256 -0.429 . . . . 1.7 110.77 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 69' ' ' MET . 82.7 tttt -57.49 -37.49 73.02 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.476 0.655 . . . . 3.96 110.254 -176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.4 tm? -65.89 -45.69 81.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.02 -0.991 . . . . 1.5 109.958 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -78.3 -30.75 48.52 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.113 -0.699 . . . . 2.3399999999999999 109.113 -172.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.78 -45.51 94.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.155 -0.929 . . . . 0.40000000000000002 111.534 176.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.512 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 53.1 mtm -59.61 -48.36 81.95 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.381 0.61 . . . . 0.71999999999999997 109.873 176.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' LEU . 96.4 t -54.88 -45.53 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 114.915 -1.039 . . . . 0.79000000000000004 110.611 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -63.61 -38.12 89.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 1.47 111.663 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.0 m -61.03 -37.48 82.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.082 0.468 . . . . 1.26 110.791 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.0 mttm -73.47 -48.17 35.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.833 -0.621 . . . . 1.54 110.003 176.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.52 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 81.1 mt -62.08 -20.62 24.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.665 0.745 . . . . 0.34000000000000002 110.678 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.41 -27.81 61.66 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.394 -0.821 . . . . 0.34999999999999998 109.793 177.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.35 0.79 57.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.402 -1.272 . . . . 0.48999999999999999 110.279 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 77' ' ' LEU . 7.6 tp -96.02 140.34 30.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.726 -0.67 . . . . 0.70999999999999996 110.634 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.86 160.21 53.18 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.998 -0.62 . . . . 0.76000000000000001 112.158 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -48.04 -42.96 31.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.929 3.086 . . . . 1.5600000000000001 113.657 -174.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.13 -45.19 74.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.601 -0.272 . . . . 2.52 110.966 -177.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.87 -30.83 40.35 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.002 -0.679 . . . . 0.35999999999999999 110.297 -176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 41.1 ttmt -62.78 -40.72 98.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.625 -0.716 . . . . 2.04 110.704 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.5 -36.93 93.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.878 -0.677 . . . . 0.40999999999999998 111.869 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -68.55 -46.5 69.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.192 . . . . 1.6499999999999999 110.545 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.78 -55.24 36.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.74 0.305 . . . . 0.40999999999999998 111.547 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -84.26 39.46 0.72 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 1.96 110.691 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.547 ' O ' HG13 ' A' ' 91' ' ' ILE . 61.1 tttp -149.51 -43.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.681 -0.69 . . . . 2.1200000000000001 109.285 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.7 p -67.31 -44.2 79.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.335 -0.393 . . . . 0.56999999999999995 110.156 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 61.0 mt -64.06 -32.97 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-N 116.109 -0.496 . . . . 1.0900000000000001 110.183 176.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -60.79 -35.72 77.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.968 0.413 . . . . 2.8199999999999998 110.069 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 87' ' ' LYS . 54.1 mt -72.22 -50.59 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.51000000000000001 110.027 176.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.84 99.77 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.862 -0.608 . . . . 0.64000000000000001 111.484 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.03 -37.08 84.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.749 -0.659 . . . . 4.4199999999999999 110.006 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.38 -31.9 81.01 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 121.096 -0.573 . . . . 0.66000000000000003 111.916 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.8 mm -62.99 -53.54 45.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 0.55000000000000004 110.667 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HD2' HD11 ' A' ' 22' ' ' LEU . 55.7 pttt -84.36 3.44 35.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.204 -0.453 . . . . 2.7000000000000002 110.904 -178.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.618 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -91.5 -34.56 14.74 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.779 -0.452 . . . . 0.63 109.779 170.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 7.3 ptp180 -83.68 -3.59 57.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.261 -0.644 . . . . 3.1000000000000001 109.261 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.2 m-85 -79.33 -34.42 42.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.709 -0.478 . . . . 0.96999999999999997 109.709 164.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.593 ' HD2' ' CE2' ' A' ' 37' ' ' PHE . 22.9 m-85 -67.62 -44.92 76.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.373 0.606 . . . . 1.48 110.642 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.6 p -66.22 -21.93 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.078 -0.964 . . . . 0.87 112.675 -174.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.75 1.03 56.36 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.871 -0.681 . . . . 1.1599999999999999 112.067 -174.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -93.6 56.88 2.46 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.878 0.37 . . . . 1.8300000000000001 110.02 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -55.7 119.36 24.76 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.495 -0.775 . . . . 1.75 111.98 -172.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.498 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 36.8 Cg_endo -67.38 146.81 76.28 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.409 2.739 . . . . 0.53000000000000003 112.543 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -77.32 168.27 20.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.777 -0.453 . . . . 1.48 109.777 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -56.77 -32.65 65.84 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.473 0.654 . . . . 2.8799999999999999 111.163 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -83.28 -14.57 52.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.561 -0.745 . . . . 2.2400000000000002 111.468 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 105' ' ' PRO . 12.2 t70 -68.04 -40.96 82.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.608 -0.515 . . . . 1.73 109.608 174.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -30.75 71.77 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.554 -0.748 . . . . 0.81999999999999995 110.985 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -59.75 -46.55 88.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.607 -0.516 . . . . 1.74 109.607 176.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.067 -0.97 . . . . 0.46999999999999997 110.821 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.454 ' OG ' HG22 ' A' ' 91' ' ' ILE . 33.5 t -53.38 -60.54 3.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 1.3400000000000001 111.478 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.813 HG23 ' HB2' ' A' ' 152' ' ' ALA . 16.2 m -76.19 -24.02 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.014 0.435 . . . . 0.65000000000000002 110.824 -172.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -54.94 -45.57 74.86 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.865 -0.607 . . . . 1.72 110.758 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.509 ' O ' HD13 ' A' ' 120' ' ' LEU . 31.7 mt-10 -75.03 -31.99 61.48 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.313 -0.555 . . . . 2.27 111.108 -178.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.3 m -65.29 -32.67 59.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 119.647 -0.821 . . . . 0.81000000000000005 109.92 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 149' ' ' ALA . 83.0 mt -75.35 -36.4 61.0 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.416 . . . . 1.21 109.878 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.13 -38.09 82.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.467 0.651 . . . . 0.94999999999999996 109.486 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.509 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -78.7 -44.51 23.41 Favored 'General case' 0 N--CA 1.438 -1.025 0 CA-C-N 115.136 -0.938 . . . . 1.0600000000000001 112.073 174.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -72.91 -32.44 65.33 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 119.476 -0.89 . . . . 1.54 111.759 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -66.78 -32.73 74.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.084 0.469 . . . . 1.98 110.632 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.85 -9.52 59.28 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.775 0.657 . . . . 0.69999999999999996 112.775 -174.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.0 mtm -75.07 154.7 37.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.317 -0.553 . . . . 0.5 110.608 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.3 m -64.4 143.72 57.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.11 -0.33 . . . . 1.1799999999999999 110.11 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.68 -45.93 63.63 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.317 0.488 . . . . 2.21 112.317 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.97 -33.34 73.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.89 0.376 . . . . 0.41999999999999998 111.032 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -75.03 -35.24 50.33 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.536 -0.626 . . . . 0.31 111.536 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.65 -43.13 94.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.197 0.522 . . . . 1.3200000000000001 109.617 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.57 -29.86 66.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.53 -0.759 . . . . 0.41999999999999998 111.467 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -75.19 -30.62 60.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.071 0.462 . . . . 0.55000000000000004 109.803 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.413 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.8 t80 -61.65 -27.21 68.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.604 . . . . 0.39000000000000001 110.162 172.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.82 -3.35 73.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.942 -0.646 . . . . 0.27000000000000002 113.052 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -96.54 -39.94 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.481 0.657 . . . . 2.4300000000000002 109.915 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -86.39 -32.42 20.94 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.884 -1.053 . . . . 1.8300000000000001 110.634 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.458 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 53.1 m-85 -136.24 73.1 58.23 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.994 0.426 . . . . 0.68999999999999995 110.951 174.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.99 -36.72 81.41 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.287 2.658 . . . . 0.63 112.942 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 38.2 t80 -61.71 -40.08 93.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.508 -0.314 . . . . 2.3100000000000001 110.878 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -77.37 -43.22 33.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 1.02 110.604 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.07 -40.07 73.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 0.34999999999999998 109.947 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.471 ' HA ' ' HE3' ' A' ' 141' ' ' LYS . 0.0 OUTLIER -44.95 -68.06 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.955 -1.02 . . . . 2.5800000000000001 111.613 173.449 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.508 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.0 OUTLIER -65.0 -22.77 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.229 -0.896 . . . . 0.5 112.132 -174.94 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -78.99 -38.92 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.191 -0.604 . . . . 0.62 110.739 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 49.6 mt-10 -71.09 -43.85 66.88 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.908 0.385 . . . . 2.5800000000000001 110.316 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.0 m -69.78 -20.0 63.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.742 -0.663 . . . . 1.3200000000000001 111.059 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 86.07 15.34 65.09 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.767 -0.73 . . . . 1.0900000000000001 112.583 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.534 ' CD ' HD21 ' A' ' 13' ' ' LEU . 0.7 OUTLIER -63.02 -42.92 99.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.491 -0.559 . . . . 1.98 109.491 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -69.93 -32.75 71.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.34000000000000002 110.298 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.505 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -60.84 -41.67 96.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.839 -0.618 . . . . 0.51000000000000001 111.052 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -71.38 -8.97 57.26 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.842 0.353 . . . . 2.8199999999999998 111.512 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -93.99 -40.53 10.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.945 0.402 . . . . 0.48999999999999999 109.953 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.813 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.18 -24.59 51.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.823 -0.626 . . . . 0.58999999999999997 112.362 -178.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.714 0 N-CA-C 110.012 -1.235 . . . . 1.6200000000000001 110.012 -169.478 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.3 p90 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.364 0.602 . . . . 1.47 111.705 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 71.8 mmtt -111.14 171.88 7.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.712 -0.676 . . . . 3.1499999999999999 109.369 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 75.7 t80 -61.81 -50.44 72.28 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.153 0.502 . . . . 2.3500000000000001 109.971 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.41 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 9.5 pt-20 -74.3 -6.43 47.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 4.1600000000000001 111.883 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.424 ' CB ' ' H ' ' A' ' 2' ' ' LYS . 11.7 t70 -78.88 -29.61 44.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.294 -0.632 . . . . 2.5699999999999998 109.294 -177.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.8 mt -69.31 135.6 88.9 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.625 -0.716 . . . . 0.68999999999999995 109.093 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -45.46 119.72 2.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.259 2.639 . . . . 0.59999999999999998 112.28 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.24 -18.66 65.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.56999999999999995 112.123 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.68 -33.72 75.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.984 0.897 . . . . 1.3700000000000001 109.251 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -82.61 -29.32 30.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 113.99 -1.459 . . . . 0.80000000000000004 111.26 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 18.5 mtm180 -71.98 -18.08 62.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.455 0.645 . . . . 1.73 109.483 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.61 -27.24 63.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.727 -1.124 . . . . 1.02 110.634 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.479 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 71.8 mt -77.26 -51.54 10.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.976 -0.557 . . . . 0.93000000000000005 111.385 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.447 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 25.3 ptt? -75.3 136.9 71.83 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 1.1499999999999999 111.515 -174.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 31.7 Cg_exo -59.68 159.8 23.16 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.534 2.823 . . . . 0.90000000000000002 112.957 -177.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -53.34 -31.41 56.87 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.55 2.833 . . . . 0.95999999999999996 112.952 -178.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.518 ' O ' HD21 ' A' ' 66' ' ' LEU . 43.8 mt-10 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.816 0.341 . . . . 1.8300000000000001 110.564 177.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -21.32 66.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.319 -0.401 . . . . 0.81999999999999995 111.187 -178.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 11' ' ' ARG . 20.0 mtm180 -88.39 -31.18 18.98 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.955 -0.566 . . . . 2.1600000000000001 110.715 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -52.15 -51.23 59.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.99 -0.55 . . . . 1.0600000000000001 111.262 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.564 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.6 t80 -55.41 -61.56 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.65000000000000002 111.627 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 59.9 mt -74.46 -9.19 58.35 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 119.108 0.867 . . . . 1.1299999999999999 111.944 -176.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -69.35 -40.24 77.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.192 0.52 . . . . 2.0600000000000001 109.989 163.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.88 -47.11 40.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.446 -0.797 . . . . 1.8400000000000001 111.074 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.612 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.9 mm? -59.85 141.54 55.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.4 0.619 . . . . 1.05 111.202 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.6 t -116.14 -63.76 1.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.78 110.314 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -176.02 -47.83 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.134 0.271 . . . . 2.3900000000000001 111.432 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.61 -34.64 79.1 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.519 -0.848 . . . . 0.93000000000000005 111.305 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -36.93 69.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 2.25 109.946 173.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 88.5 mttt -61.64 -26.88 68.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.329 -0.85 . . . . 1.3100000000000001 111.61 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 21.7 m -64.64 -35.67 81.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 0.80000000000000004 110.35 177.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.6 t -66.27 -41.03 88.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.84999999999999998 110.715 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.582 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.4 mm? -56.77 -46.27 81.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.915 0.388 . . . . 0.97999999999999998 110.417 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -55.88 -43.21 76.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 2.4100000000000001 111.681 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 31' ' ' THR . 40.4 mm-40 -69.86 -33.2 71.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 1.96 111.407 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 67.6 t -75.59 -51.27 21.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.97999999999999998 110.8 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.427 ' HB3' ' CG2' ' A' ' 101' ' ' THR . 14.6 m-85 -48.14 -50.61 28.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.791 1.034 . . . . 0.82999999999999996 113.791 174.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -73.73 -25.55 60.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.115 -0.634 . . . . 2.1800000000000002 111.571 -175.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.56 -79.16 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.17 -0.308 . . . . 1.5600000000000001 110.17 174.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.538 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.43 -148.23 3.41 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.749 -0.739 . . . . 1.54 112.395 -173.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.458 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.5 149.82 12.9 Favored 'Cis proline' 0 N--CA 1.454 -0.813 0 CA-C-N 118.734 1.267 . . . . 1.6799999999999999 111.116 -8.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.538 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 18.0 m-85 -118.44 128.12 54.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.485 0.659 . . . . 1.28 111.62 -170.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -86.89 -15.15 39.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.67 -1.15 . . . . 3.5099999999999998 108.314 175.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 47' ' ' GLU . 7.3 p30 -150.71 150.52 31.16 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.079 -1.082 . . . . 1.52 108.079 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.562 HG21 ' NE2' ' A' ' 67' ' ' HIS . 4.7 m -77.04 -16.12 59.38 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.87 -0.332 . . . . 1.1799999999999999 111.694 -171.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -62.45 -26.88 68.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 2.2400000000000002 110.21 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.7 mt-10 -65.09 -41.37 95.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 2.2599999999999998 110.583 173.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 41.2 t -69.17 -41.46 77.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.143 0.496 . . . . 1.1899999999999999 110.046 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 98.0 mt -61.01 -44.33 97.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.674 -0.694 . . . . 0.55000000000000004 110.057 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -51.42 69.54 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 0.56999999999999995 111.661 174.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -56.93 -43.16 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.5 110.718 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.56 HD21 HD13 ' A' ' 33' ' ' LEU . 45.9 mt -68.36 -34.03 75.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.298 -0.864 . . . . 0.45000000000000001 111.241 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.09 -28.52 68.25 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.739 0.304 . . . . 1.22 111.222 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -76.52 -45.13 32.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.035 0.445 . . . . 3.0499999999999998 110.739 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 31.1 mmmt -67.27 -46.77 72.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.865 -0.607 . . . . 1.48 111.149 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.447 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 22.9 t -149.5 102.18 3.29 Favored Pre-proline 0 C--N 1.315 -0.919 0 C-N-CA 120.818 -0.353 . . . . 1.1599999999999999 110.327 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 4.4 Cg_endo -47.09 -59.62 1.18 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 123.581 2.854 . . . . 0.57999999999999996 113.346 -168.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.16 -28.04 66.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.578 -0.737 . . . . 2.4500000000000002 111.283 -177.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -40.36 81.47 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.241 -1.022 . . . . 1.4199999999999999 108.241 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.81 -23.08 65.08 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.365 -1.289 . . . . 0.37 112.156 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.72 -31.1 66.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.867 0.365 . . . . 0.47999999999999998 110.733 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.63 -47.23 76.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.289 -0.414 . . . . 2.1699999999999999 110.539 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.39 -29.0 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 1.1200000000000001 110.736 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 4.9 tm-20 -60.79 -55.17 36.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.692 -0.686 . . . . 1.7 110.239 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.5 ptmm? -62.52 -30.28 71.17 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-O 121.148 0.499 . . . . 3.96 109.911 -176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.49 -1.45 15.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.514 -0.766 . . . . 1.5 111.274 -176.547 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.632 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 67.5 m80 -118.88 -46.79 2.53 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.241 -0.436 . . . . 2.3399999999999999 110.821 175.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.42 -43.41 83.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.612 0.227 . . . . 0.40000000000000002 111.612 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 33.8 mtm -61.2 -41.34 96.66 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.474 0.654 . . . . 0.71999999999999997 110.237 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.0 t -71.39 -40.41 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.211 -0.904 . . . . 0.79000000000000004 110.76 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 30.4 mmmt -60.55 -34.93 74.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.735 -0.666 . . . . 1.47 111.018 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.3 m -60.2 -33.0 71.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.289 0.566 . . . . 1.26 111.135 177.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.432 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.2 mttp -82.24 -42.59 18.7 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.562 -0.744 . . . . 1.54 110.194 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -69.6 -24.07 26.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.213 0.53 . . . . 0.34000000000000002 111.055 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.0 -26.82 64.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.945 0.879 . . . . 0.34999999999999998 109.558 174.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.34 2.5 55.82 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.32 -1.309 . . . . 0.48999999999999999 110.101 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 132' ' ' PHE . 12.1 tp -96.44 136.35 37.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.533 -0.758 . . . . 0.70999999999999996 109.958 -175.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.5 153.05 51.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.592 -0.813 . . . . 0.76000000000000001 112.32 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -42.53 -41.31 7.91 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 124.558 3.505 . . . . 1.5600000000000001 113.518 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -64.01 -49.52 72.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.948 -0.569 . . . . 2.52 110.787 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.535 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.05 -31.91 34.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.904 -0.589 . . . . 0.35999999999999999 110.664 -176.025 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -56.02 -48.03 76.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 2.04 110.881 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.04 -40.0 94.99 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.819 -0.705 . . . . 0.40999999999999998 111.917 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 121' ' ' TYR . 4.9 t80 -69.37 -44.23 71.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.74 -0.23 . . . . 1.6499999999999999 111.08 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.38 -49.72 76.24 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.089 0.471 . . . . 0.40999999999999998 111.047 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -67.32 -14.23 62.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.611 -0.722 . . . . 1.96 111.058 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -94.53 -46.5 6.95 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.476 -0.329 . . . . 2.1200000000000001 110.691 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 p -65.25 -34.22 77.83 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.321 -0.4 . . . . 0.56999999999999995 110.728 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.441 HG23 ' NH1' ' A' ' 93' ' ' ARG . 17.7 mt -55.77 -46.05 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 115.979 -0.555 . . . . 1.0900000000000001 110.745 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.775 0.322 . . . . 2.8199999999999998 110.989 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.63 -51.81 47.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.51000000000000001 110.351 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.12 68.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.64000000000000001 110.934 -178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' A' ' 66' ' ' LEU . 4.4 mpt_? -69.7 -32.79 71.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.938 -0.574 . . . . 4.4199999999999999 110.28 173.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -65.61 -38.73 94.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.155 -0.545 . . . . 0.66000000000000003 112.081 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.425 HD11 ' CB ' ' A' ' 113' ' ' SER . 38.9 mm -56.64 -51.04 71.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.26 0.552 . . . . 0.55000000000000004 110.129 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.2 mppt? -93.8 28.64 2.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.807 -0.633 . . . . 2.7000000000000002 110.181 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -108.1 -33.66 7.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.457 -0.942 . . . . 0.63 108.457 164.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.672 ' HB2' ' ND2' ' A' ' 103' ' ' ASN . 5.2 ptp180 -86.17 -9.65 56.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.543 -0.753 . . . . 3.1000000000000001 109.995 175.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 12.9 m-85 -77.38 -29.97 53.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.112 -0.699 . . . . 0.96999999999999997 109.112 163.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' ' HG ' ' A' ' 25' ' ' LEU . 2.5 m-85 -83.94 -52.77 6.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.515 -0.766 . . . . 1.48 111.994 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 10.5 p -59.12 -26.3 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.299 0.852 . . . . 0.87 113.299 -173.012 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 108.89 39.31 1.73 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.699 -0.762 . . . . 1.1599999999999999 113.608 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.672 ' ND2' ' HB2' ' A' ' 98' ' ' ARG . 4.2 p-10 -149.08 68.8 1.05 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.33 0.586 . . . . 1.8300000000000001 109.995 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -45.12 125.89 5.53 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 114.834 -1.075 . . . . 1.75 111.944 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.48 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 58.1 Cg_endo -74.19 155.35 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.989 2.459 . . . . 0.53000000000000003 111.937 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 171.63 8.96 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.145 -0.687 . . . . 1.48 109.145 173.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -62.01 -29.8 70.51 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.388 -0.525 . . . . 2.8799999999999999 110.646 -176.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.36 -31.31 72.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.879 -0.6 . . . . 2.2400000000000002 110.863 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.99 -46.81 70.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.375 -0.375 . . . . 1.73 110.292 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.597 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.0 mp -63.81 -43.1 97.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.81999999999999995 110.031 176.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 151' ' ' PHE . 41.8 tttp -52.6 -53.29 48.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.651 -0.704 . . . . 1.74 110.528 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -62.65 -39.25 93.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.284 -0.871 . . . . 0.46999999999999997 111.592 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.425 ' CB ' HD11 ' A' ' 95' ' ' ILE . 49.4 m -67.48 -44.5 78.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.841 0.682 . . . . 1.3400000000000001 112.841 -178.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.597 HG13 ' O ' ' A' ' 110' ' ' LEU . 2.9 m -71.27 -28.38 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 N-CA-C 108.607 -0.886 . . . . 0.65000000000000002 108.607 -179.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 84.4 tttt -53.62 -39.17 64.71 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.295 . . . . 1.72 111.25 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.566 ' O ' HD13 ' A' ' 120' ' ' LEU . 25.3 mt-10 -73.72 -36.82 65.24 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 120.113 -0.635 . . . . 2.27 111.322 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.8 m -64.77 -31.92 55.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 C-N-CA 119.98 -0.688 . . . . 0.81000000000000005 110.459 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.47 HD23 ' HE2' ' A' ' 122' ' ' LYS . 6.8 mp -80.05 -31.76 39.45 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.768 -0.583 . . . . 1.21 110.483 172.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -55.12 -42.7 73.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.852 0.834 . . . . 0.94999999999999996 109.369 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -77.37 -47.02 20.97 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.45 -1.25 . . . . 1.0600000000000001 112.11 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.456 ' HB2' ' CE2' ' A' ' 84' ' ' PHE . 20.6 t80 -70.33 -33.75 71.85 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 119.61 -0.836 . . . . 1.54 111.775 -170.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.47 ' HE2' HD23 ' A' ' 118' ' ' LEU . 68.1 mttm -66.82 -30.6 70.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 1.98 111.174 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -84.84 -7.27 59.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.756 -0.656 . . . . 0.69999999999999996 112.604 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.535 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 58.7 mtm -74.53 158.44 33.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.506 -0.478 . . . . 0.5 110.951 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 7.3 m -65.07 145.72 55.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.45 -0.341 . . . . 1.1799999999999999 110.282 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.75 -47.25 70.84 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.01 0.374 . . . . 2.21 112.01 -173.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.86 -27.46 69.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.41999999999999998 110.992 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.48 -34.22 29.29 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.743 -0.543 . . . . 0.31 111.743 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -66.78 -45.04 79.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 1.3200000000000001 109.98 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 134' ' ' LYS . . . -68.7 -26.44 65.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.367 -0.833 . . . . 0.41999999999999998 110.691 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.458 ' OD2' HD12 ' A' ' 77' ' ' LEU . 24.6 t70 -78.28 -29.28 47.87 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.209 -0.663 . . . . 0.55000000000000004 109.209 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.496 ' HA ' HD11 ' A' ' 77' ' ' LEU . 84.2 t80 -66.4 -34.05 77.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 0.39000000000000001 110.189 173.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.31 -13.96 65.79 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.933 -0.651 . . . . 0.27000000000000002 112.704 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 130' ' ' ALA . 58.2 mttm -91.17 -16.69 27.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.224 0.535 . . . . 2.4300000000000002 110.529 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.432 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 57.2 mm-40 -110.87 -35.92 5.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.617 -0.72 . . . . 1.8300000000000001 110.27 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -122.68 76.41 47.01 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.589 -0.523 . . . . 0.68999999999999995 109.589 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.14 -30.32 46.86 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.828 2.352 . . . . 0.63 113.074 -172.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.604 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 11.9 m-85 -77.76 -36.06 51.07 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.186 0.439 . . . . 2.3100000000000001 112.186 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.3 mt -71.81 -47.53 52.67 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 119.904 -0.718 . . . . 1.02 109.716 177.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.42 72.63 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.054 0.454 . . . . 0.34999999999999998 110.051 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 84.1 tttt -50.25 -73.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.272 -0.876 . . . . 2.5800000000000001 111.19 171.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.7 m -65.39 -25.54 37.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.336 -0.847 . . . . 0.5 112.667 -172.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 20.0 m-30 -69.5 -50.79 41.89 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.557 -0.457 . . . . 0.62 110.606 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.7 -28.75 64.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 2.5800000000000001 111.425 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.1 m -76.56 -9.45 58.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.02 0.438 . . . . 1.3200000000000001 110.729 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 78.56 17.65 77.21 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 121.128 -0.558 . . . . 1.0900000000000001 112.621 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.479 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 0.8 OUTLIER -74.27 -51.73 14.43 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.407 -0.59 . . . . 1.98 109.407 -178.667 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.6 -33.85 76.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.132 0.492 . . . . 0.34000000000000002 110.166 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -60.58 -35.6 76.47 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.51000000000000001 110.781 176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -73.23 -34.65 66.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.046 0.45 . . . . 2.8199999999999998 110.483 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.485 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 38.1 t80 -63.56 -45.11 92.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 0.48999999999999999 109.705 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -75.07 -22.24 58.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.858 -0.61 . . . . 0.58999999999999997 111.519 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 110.282 -1.127 . . . . 1.6200000000000001 110.282 -175.208 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.706 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 67.8 t80 . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.828 0.347 . . . . 1.47 110.908 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 28.8 mtmm -120.86 -83.15 0.66 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.283 -0.417 . . . . 3.1499999999999999 111.018 174.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 47.4 t80 167.25 -42.74 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.669 -0.863 . . . . 2.3500000000000001 108.669 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.459 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 52.7 mt-10 -66.49 -18.88 65.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.932 -1.031 . . . . 4.1600000000000001 110.685 175.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.75 -5.34 57.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.522 . . . . 2.5699999999999998 111.193 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 1' ' ' PHE . 44.7 mt -80.84 137.16 50.53 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 108.702 -0.851 . . . . 0.68999999999999995 108.702 174.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -46.9 115.39 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.709 2.272 . . . . 0.59999999999999998 111.716 176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.86 -20.55 65.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.043 -0.526 . . . . 0.56999999999999995 111.209 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.03 -35.92 82.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.648 0.737 . . . . 1.3700000000000001 110.097 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -83.66 -29.16 27.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.688 -1.142 . . . . 0.80000000000000004 111.414 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 20.9 mtm180 -69.23 -20.85 63.96 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.508 0.671 . . . . 1.73 109.427 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -68.16 -15.14 63.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.597 -1.183 . . . . 1.02 110.473 175.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.3 mt -104.27 -0.46 28.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.93000000000000005 110.827 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.5 mtt -81.67 130.32 61.82 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.605 -0.271 . . . . 1.1499999999999999 111.281 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -56.43 138.59 84.65 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.731 2.287 . . . . 0.90000000000000002 111.505 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.417 ' HD3' ' CG ' ' A' ' 138' ' ' PHE . 18.7 Cg_endo -59.26 -29.37 90.15 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.53 2.82 . . . . 0.95999999999999996 112.79 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -70.48 -49.08 52.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.233 -0.44 . . . . 1.8300000000000001 110.083 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.9 71.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 0.81999999999999995 110.956 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -67.87 -40.64 83.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 2.1600000000000001 111.022 177.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -52.88 -46.03 67.76 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.397 0.436 . . . . 1.0600000000000001 111.278 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.635 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 30.9 t80 -57.74 -61.0 2.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 0.65000000000000002 111.265 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 25' ' ' LEU . 8.2 mp -72.69 -8.25 54.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.994 0.816 . . . . 1.1299999999999999 112.261 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -70.68 -57.35 4.78 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.852 0.358 . . . . 2.0600000000000001 110.986 163.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.22 -37.07 33.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.036 -0.529 . . . . 1.8400000000000001 111.905 -171.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.72 ' CD1' ' HB2' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -63.89 137.19 57.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 109.653 -0.499 . . . . 1.05 109.653 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.7 p -123.95 179.37 4.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.456 -0.338 . . . . 1.78 111.77 -170.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -56.45 -41.06 75.86 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.845 0.683 . . . . 2.3900000000000001 112.845 -171.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.16 -34.06 82.49 Favored Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.727 -0.749 . . . . 0.93000000000000005 112.481 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.72 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -85.0 -33.82 22.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.979 0.419 . . . . 2.25 109.887 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HG3' HD11 ' A' ' 25' ' ' LEU . 87.0 mttt -66.98 -10.8 53.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.557 0.694 . . . . 1.3100000000000001 109.99 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 90.6 m -74.2 -31.94 62.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.871 -1.059 . . . . 0.80000000000000004 110.486 174.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.642 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 10.2 p -87.14 -28.82 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 120.671 -0.411 . . . . 0.84999999999999998 110.913 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.402 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.3 mm? -52.19 -48.7 64.89 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.348 0.118 . . . . 0.97999999999999998 111.182 174.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -63.84 -34.18 77.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.767 0.318 . . . . 2.4100000000000001 111.438 -178.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -68.9 -39.61 79.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.375 -0.375 . . . . 1.96 110.84 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.98 -43.81 38.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-O 121.177 0.513 . . . . 0.97999999999999998 111.103 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.402 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 20.0 m-85 -60.2 -33.74 72.66 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 113.661 0.986 . . . . 0.82999999999999996 113.661 174.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -92.52 9.39 34.71 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.656 -0.818 . . . . 2.1800000000000002 110.547 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -101.97 -78.9 0.53 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.334 -0.848 . . . . 1.5600000000000001 108.887 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.532 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.59 -151.35 3.03 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.85 -0.691 . . . . 1.54 112.808 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.29 130.92 5.83 Favored 'Cis proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.163 -1.182 . . . . 1.6799999999999999 110.916 -9.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.532 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 19.5 m-85 -105.55 120.29 41.27 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.438 -0.801 . . . . 1.28 111.31 -170.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -73.14 -16.86 61.44 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.089 -0.96 . . . . 3.5099999999999998 110.212 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.425 HD21 ' HG3' ' A' ' 47' ' ' GLU . 6.9 p30 -144.39 174.54 10.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.233 -0.439 . . . . 1.52 110.17 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.7 m -75.89 -37.05 59.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 1.1799999999999999 111.165 -177.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -60.16 -35.24 74.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.023 -0.535 . . . . 2.2400000000000002 112.321 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.8 mt-10 -61.28 -36.63 80.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.895 0.378 . . . . 2.2599999999999998 110.985 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 30.0 t -74.34 -34.91 63.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.853 -0.425 . . . . 1.1899999999999999 109.853 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.6 mt -62.92 -42.26 95.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.561 0.696 . . . . 0.55000000000000004 109.6 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.85 76.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.667 -1.151 . . . . 0.56999999999999995 111.802 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.05 79.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.087 -0.506 . . . . 0.5 110.896 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.99 -40.32 83.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 0.45000000000000001 110.855 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -62.38 -34.71 77.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.692 0.282 . . . . 1.22 111.657 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -66.23 -44.48 83.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.437 . . . . 3.0499999999999998 110.84 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.642 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 8.5 tppt? -77.11 -56.32 4.67 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.937 0.398 . . . . 1.48 110.543 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 52.3 m -125.34 103.99 28.9 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-O 121.51 0.671 . . . . 1.1599999999999999 109.992 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 19.7 Cg_endo -58.63 -56.21 1.63 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.635 2.89 . . . . 0.57999999999999996 113.361 -170.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 48.6 mm-40 -73.88 -24.27 59.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.802 -0.636 . . . . 2.4500000000000002 111.084 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.552 ' HG ' ' HB3' ' A' ' 29' ' ' ASP . 0.9 OUTLIER -71.05 -42.92 68.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.813 -0.81 . . . . 1.4199999999999999 108.813 -178.078 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.62 -24.36 76.95 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.392 -1.276 . . . . 0.37 111.619 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.02 74.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.809 0.337 . . . . 0.47999999999999998 110.82 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 66.9 mttm -60.56 -54.7 42.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.956 -0.565 . . . . 2.1699999999999999 110.72 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.78 -30.21 49.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 1.1200000000000001 110.958 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -61.36 -60.37 3.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.279 -0.419 . . . . 1.7 111.164 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.527 ' O ' ' HG3' ' A' ' 69' ' ' MET . 91.5 mttt -62.52 -33.2 74.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 3.96 110.345 -176.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.61 HD22 ' HB2' ' A' ' 21' ' ' PHE . 34.2 tp -64.9 -41.3 95.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.352 -0.84 . . . . 1.5 110.602 176.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -72.66 -32.09 65.59 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.955 -0.757 . . . . 2.3399999999999999 108.955 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.53 -36.02 76.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.409 -1.269 . . . . 0.40000000000000002 111.526 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 44.2 mtm -65.59 -51.28 60.93 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.262 0.553 . . . . 0.71999999999999997 110.137 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.47 -39.68 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.312 -0.858 . . . . 0.79000000000000004 110.094 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tpmt? -60.06 -40.39 89.3 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.615 -0.721 . . . . 1.47 110.439 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -61.64 -38.13 86.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.05 0.452 . . . . 1.26 110.685 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -75.55 -47.19 27.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.052 -0.522 . . . . 1.54 110.341 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.406 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 73.2 mt -63.2 -20.96 27.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.586 0.708 . . . . 0.34000000000000002 110.388 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.29 -30.73 63.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.2 -0.909 . . . . 0.34999999999999998 110.005 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.1 -3.2 58.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.44 -1.254 . . . . 0.48999999999999999 110.008 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.3 tp -91.95 130.54 37.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.241 -0.89 . . . . 0.70999999999999996 109.596 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.91 155.25 50.65 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.84 -0.695 . . . . 0.76000000000000001 111.741 -178.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -44.37 -40.19 12.96 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.659 2.906 . . . . 1.5600000000000001 114.073 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -62.46 -41.21 98.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 2.52 111.012 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.416 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -92.93 -32.42 14.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.144 0.497 . . . . 0.35999999999999999 111.038 -177.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.0 ttpt -60.31 -39.5 87.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.615 -0.721 . . . . 2.04 111.305 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.05 -44.02 98.35 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.473 -0.87 . . . . 0.40999999999999998 111.727 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -67.67 -45.57 74.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.247 . . . . 1.6499999999999999 111.422 178.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.763 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -52.32 -60.21 3.49 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.239 0.337 . . . . 0.40999999999999998 111.469 -176.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 32.3 mt-10 -62.4 -36.14 81.4 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.823 -0.351 . . . . 1.96 110.973 -174.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -70.5 -41.84 72.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.278 -0.419 . . . . 2.1200000000000001 110.974 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.3 p -69.68 -32.48 71.12 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.936 -0.306 . . . . 0.56999999999999995 110.515 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.763 HG12 ' O ' ' A' ' 85' ' ' ALA . 46.2 mm -59.51 -39.06 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.787 -0.449 . . . . 1.0900000000000001 109.787 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.628 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 52.3 mt-10 -60.48 -43.07 97.35 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.343 -0.389 . . . . 2.8199999999999998 110.47 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.2 mt -65.63 -46.06 90.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.51000000000000001 111.05 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -31.59 71.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.225 0.535 . . . . 0.64000000000000001 110.421 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.488 ' NH2' ' HG2' ' A' ' 90' ' ' GLU . 43.2 mtm180 -69.84 -35.98 75.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.871 -0.604 . . . . 4.4199999999999999 110.457 174.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.3 98.22 Favored Glycine 0 N--CA 1.451 -0.325 0 O-C-N 123.325 0.391 . . . . 0.66000000000000003 113.005 -176.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.9 mm -59.01 -49.07 84.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.202 0.525 . . . . 0.55000000000000004 110.533 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 20.6 pttp -81.29 -7.71 59.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.866 -0.606 . . . . 2.7000000000000002 111.232 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -77.34 -39.88 46.05 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.3 0.571 . . . . 0.63 109.983 174.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -86.92 10.03 17.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.613 -0.721 . . . . 3.1000000000000001 109.645 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.706 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.4 m-85 -98.43 -40.23 8.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.574 -0.739 . . . . 0.96999999999999997 110.017 162.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -55.35 -38.99 69.49 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.168 0.509 . . . . 1.48 111.251 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.7 p -70.66 -1.97 12.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.272 -0.876 . . . . 0.87 112.817 -173.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.7 2.31 75.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.626 -0.797 . . . . 1.1599999999999999 111.345 -175.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -90.53 169.93 10.62 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.035 -0.728 . . . . 1.8300000000000001 109.035 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.1 mt-10 -142.59 106.09 5.46 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.582 0.23 . . . . 1.75 110.751 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.567 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 23.0 Cg_endo -64.74 141.09 70.62 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.434 2.09 . . . . 0.53000000000000003 111.304 174.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.4 t -72.56 161.26 31.02 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.055 -0.72 . . . . 1.48 109.055 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -19.63 63.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.818 0.342 . . . . 2.8799999999999999 111.145 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.21 -40.92 86.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.254 -0.43 . . . . 2.2400000000000002 110.185 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -58.27 -41.48 84.42 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.43 0.633 . . . . 1.73 110.243 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.53 ' O ' HG23 ' A' ' 114' ' ' VAL . 11.0 mp -64.49 -50.75 66.21 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.92 -1.036 . . . . 0.81999999999999995 110.42 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -53.51 -52.82 58.38 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.404 -0.362 . . . . 1.74 110.951 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.72 86.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.912 -0.585 . . . . 0.46999999999999997 111.321 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 117' ' ' VAL . 68.6 m -66.74 -39.02 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.284 -0.416 . . . . 1.3400000000000001 111.586 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 110' ' ' LEU . 48.8 t -77.93 -37.54 23.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.551 0.691 . . . . 0.65000000000000002 109.377 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -54.24 -39.83 67.15 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.792 -1.095 . . . . 1.72 110.727 173.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.52 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.6 tt0 -74.28 -32.4 62.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 116.569 -0.287 . . . . 2.27 110.385 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 113' ' ' SER . 99.3 t -59.21 -45.22 93.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.255 0.55 . . . . 0.81000000000000005 110.358 172.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.25 -28.0 65.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.614 -0.721 . . . . 1.21 110.096 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.508 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 33.3 ttpt -61.21 -42.23 98.23 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.822 -0.807 . . . . 0.94999999999999996 108.822 177.053 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.3 mp -71.87 -51.69 21.07 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.188 -0.915 . . . . 1.0600000000000001 111.374 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.616 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -69.89 -36.92 75.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 119.223 -0.991 . . . . 1.54 111.862 -167.243 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -64.6 -30.27 71.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.826 0.346 . . . . 1.98 111.146 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.15 -4.85 59.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.506 0.558 . . . . 0.69999999999999996 112.506 -176.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.502 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 55.8 mtm -75.45 161.34 29.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.5 -0.48 . . . . 0.5 111.771 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.8 m -59.67 144.15 48.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.784 -0.644 . . . . 1.1799999999999999 109.785 170.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.98 -40.79 94.79 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.555 0.217 . . . . 2.21 111.378 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.34 -29.6 70.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.41999999999999998 110.636 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.28 -37.56 63.17 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.446 -0.662 . . . . 0.31 111.446 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.616 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 97.1 mttt -65.76 -46.89 77.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.261 0.553 . . . . 1.3200000000000001 109.902 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.36 -35.56 81.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.414 -0.812 . . . . 0.41999999999999998 111.472 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -76.04 -33.59 59.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.002 0.429 . . . . 0.55000000000000004 110.006 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.705 -0.679 . . . . 0.39000000000000001 110.146 172.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.56 -6.31 70.69 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 116.013 -0.54 . . . . 0.27000000000000002 113.451 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -95.53 -50.55 4.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.226 0.536 . . . . 2.4300000000000002 110.143 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.409 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -81.01 -20.92 40.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.2 -0.909 . . . . 1.8300000000000001 111.168 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -137.3 69.99 54.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.764 0.316 . . . . 0.68999999999999995 111.102 174.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.17 -42.17 59.71 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.173 2.582 . . . . 0.63 113.067 -178.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.511 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 30.7 t80 -61.87 -46.73 88.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.404 -0.362 . . . . 2.3100000000000001 111.37 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 80.7 mt -72.45 -43.09 64.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.023 -0.271 . . . . 1.02 110.911 -177.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.86 -39.42 77.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.762 0.315 . . . . 0.34999999999999998 110.225 177.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.511 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 38.9 ttpt -47.27 -66.49 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 2.5800000000000001 111.115 173.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.4 ' HA ' ' HB3' ' A' ' 147' ' ' LYS . 3.3 m -64.78 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.515 -0.766 . . . . 0.5 112.824 -174.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.511 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 21.6 m-85 -76.14 -48.99 18.52 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.847 -0.741 . . . . 0.62 110.68 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -66.24 -38.7 88.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.4 -0.363 . . . . 2.5800000000000001 111.151 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 13.5 m -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 1.3200000000000001 111.806 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 83.62 12.46 77.84 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.692 -0.766 . . . . 1.0900000000000001 112.574 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 142' ' ' VAL . 9.7 tppt? -61.5 -53.85 50.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 1.98 110.647 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.15 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 0.34000000000000002 110.657 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.66 85.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.841 -0.618 . . . . 0.51000000000000001 111.071 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 41.9 mmtm -69.95 -21.07 63.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.086 0.469 . . . . 2.8199999999999998 110.629 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -91.71 -39.71 11.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.758 -0.656 . . . . 0.48999999999999999 110.616 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.412 ' HB2' ' HB ' ' A' ' 114' ' ' VAL . . . -85.94 -4.07 59.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.58999999999999997 112.278 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 110.926 -0.87 . . . . 1.6200000000000001 110.926 -174.298 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.4 p90 . . . . . 0 C--O 1.234 0.282 0 CA-C-O 120.985 0.421 . . . . 1.47 110.467 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -123.77 153.39 41.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.534 -0.543 . . . . 3.1499999999999999 109.534 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -54.45 -45.32 73.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.281 0.562 . . . . 2.3500000000000001 109.576 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -61.93 -27.7 69.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.148 -0.933 . . . . 4.1600000000000001 112.064 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -79.44 -23.21 43.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.091 0.472 . . . . 2.5699999999999998 110.329 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.44 133.71 84.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.184 -0.673 . . . . 0.68999999999999995 109.184 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -44.25 110.46 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.14 2.56 . . . . 0.59999999999999998 112.249 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.78 -21.84 66.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.493 -0.776 . . . . 0.56999999999999995 112.209 -171.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.42 -35.42 80.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.332 0.587 . . . . 1.3700000000000001 110.316 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 14' ' ' MET . 37.5 t80 -84.42 -29.4 26.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.09 -0.959 . . . . 0.80000000000000004 110.956 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.62 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 11.9 mtm180 -65.95 -27.15 67.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.703 0.764 . . . . 1.73 109.059 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.41 -24.67 66.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.469 -1.241 . . . . 1.02 110.24 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.547 HD21 ' HG3' ' A' ' 147' ' ' LYS . 9.9 mt -97.55 1.78 49.33 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.639 -0.709 . . . . 0.93000000000000005 110.191 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 96.0 mtp -96.47 137.37 21.54 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.153 -0.476 . . . . 1.1499999999999999 110.071 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.06 142.03 95.94 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.626 2.217 . . . . 0.90000000000000002 111.678 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.69 -19.07 51.58 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.464 2.776 . . . . 0.95999999999999996 112.472 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 66' ' ' LEU . 4.0 mm-40 -62.57 -55.25 29.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.598 -0.728 . . . . 1.8300000000000001 109.616 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.87 -28.6 65.78 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.482 -0.781 . . . . 0.81999999999999995 111.01 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 35.5 mtp180 -67.12 -48.4 68.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 2.1600000000000001 110.802 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 24.8 t70 -53.7 -46.82 70.86 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.515 0.198 . . . . 1.0600000000000001 111.028 176.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.666 ' O ' HD23 ' A' ' 25' ' ' LEU . 40.3 t80 -53.44 -60.3 3.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.985 -0.552 . . . . 0.65000000000000002 111.049 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.538 HD21 ' CE1' ' A' ' 100' ' ' TYR . 83.8 mt -74.75 -4.66 38.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 119.31 0.959 . . . . 1.1299999999999999 112.388 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 43.4 mt-30 -71.92 -46.26 58.25 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 122.314 -0.241 . . . . 2.0600000000000001 111.405 162.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -83.37 -26.88 30.09 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.525 0.565 . . . . 1.8400000000000001 112.525 -175.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.666 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -63.13 134.9 56.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.841 -0.429 . . . . 1.05 109.841 166.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.8 m -159.23 55.27 0.4 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.236 0.458 . . . . 1.78 112.236 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.0 t70 71.98 143.06 0.06 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.325 0.584 . . . . 2.3900000000000001 111.238 176.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.02 -49.14 4.07 Favored Glycine 0 N--CA 1.451 -0.32 0 N-CA-C 110.776 -0.93 . . . . 0.93000000000000005 110.776 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 4.7 p30 -78.72 -49.43 13.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.112 -0.544 . . . . 2.25 110.28 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 89.2 mttt -55.32 -26.45 40.73 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.377 0.608 . . . . 1.3100000000000001 110.703 174.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 14.9 m -64.69 -32.87 74.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.212 -0.903 . . . . 0.80000000000000004 111.102 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.8 p -90.62 -23.61 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.23 -0.441 . . . . 0.84999999999999998 110.512 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.59 -49.03 71.39 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.49 -0.323 . . . . 0.97999999999999998 110.895 171.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 20.9 ptmt -65.43 -27.67 68.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.424 -0.353 . . . . 2.4100000000000001 111.407 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -67.26 -37.33 83.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 1.96 110.157 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 51' ' ' ALA . 61.4 t -73.54 -53.97 16.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.252 0.549 . . . . 0.97999999999999998 110.468 177.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HE1' HD12 ' A' ' 33' ' ' LEU . 27.5 m-85 -53.93 -45.11 71.14 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.345 1.239 . . . . 0.82999999999999996 114.345 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -79.08 -1.4 35.64 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 119.988 -0.685 . . . . 2.1800000000000002 111.16 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -99.82 17.08 21.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.394 0.616 . . . . 1.5600000000000001 109.668 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -88.06 -160.61 36.01 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.444 -0.798 . . . . 1.54 111.62 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.78 160.8 95.45 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 123.334 -1.527 . . . . 1.6799999999999999 112.256 -1.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -112.52 127.29 56.02 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.136 0.493 . . . . 1.28 110.252 177.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -65.65 -21.98 66.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.862 -1.063 . . . . 3.5099999999999998 110.996 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.77 141.48 20.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.735 -0.666 . . . . 1.52 110.093 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.4 m -57.72 -28.31 63.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.242 -0.89 . . . . 1.1799999999999999 112.215 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.64 -34.93 69.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.256 -0.429 . . . . 2.2400000000000002 111.695 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.24 -34.22 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.689 0.255 . . . . 2.2599999999999998 111.689 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m -64.57 -41.02 96.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.309 0.576 . . . . 1.1899999999999999 109.821 176.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.9 mt -67.19 -43.14 88.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.392 -0.822 . . . . 0.55000000000000004 110.561 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -58.11 -47.25 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.364 -0.835 . . . . 0.56999999999999995 110.824 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.488 ' HB3' HG13 ' A' ' 36' ' ' VAL . . . -59.38 -37.46 77.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.084 -0.507 . . . . 0.5 110.481 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.518 HD21 HD13 ' A' ' 33' ' ' LEU . 21.3 mt -69.74 -40.32 76.26 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.529 -0.759 . . . . 0.45000000000000001 110.891 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -66.56 -23.5 66.22 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.848 0.356 . . . . 1.22 111.776 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -80.41 -26.59 38.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.097 0.475 . . . . 3.0499999999999998 110.622 176.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.551 ' HB3' HG21 ' A' ' 32' ' ' VAL . 18.4 mmtt -91.95 -58.91 2.25 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.977 -0.556 . . . . 1.48 111.058 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.5 t -131.02 104.15 15.36 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-O 121.294 0.569 . . . . 1.1599999999999999 109.493 -175.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.08 -52.9 7.48 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 123.645 2.897 . . . . 0.57999999999999996 112.129 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -61.31 -41.38 96.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.612 -1.176 . . . . 2.4500000000000002 112.196 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.7 -40.01 73.11 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 119.443 -0.903 . . . . 1.4199999999999999 109.639 -173.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.69 -36.6 93.51 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 114.614 -1.175 . . . . 0.37 111.61 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.82 94.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.719 0.295 . . . . 0.47999999999999998 110.652 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -56.99 -59.66 4.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.926 -0.579 . . . . 2.1699999999999999 110.911 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.97 -32.91 59.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.421 . . . . 1.1200000000000001 111.744 -177.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.603 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -62.52 -55.61 25.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 1.7 110.484 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 69' ' ' MET . 9.0 mtpm? -67.42 -33.09 74.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.548 0.69 . . . . 3.96 110.104 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 17' ' ' GLU . 15.2 tp -66.52 -50.38 63.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.959 -1.019 . . . . 1.5 111.83 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.503 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.9 OUTLIER -74.57 -21.73 59.35 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.185 -0.672 . . . . 2.3399999999999999 109.185 -174.433 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.49 99.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.905 -1.043 . . . . 0.40000000000000002 110.648 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 28.4 mtm -63.45 -44.3 94.9 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.483 -0.562 . . . . 0.71999999999999997 109.483 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.42 -49.21 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 114.996 -1.002 . . . . 0.79000000000000004 110.299 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -62.45 -36.69 83.23 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 115.554 -0.748 . . . . 1.47 111.517 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -63.79 -41.12 98.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.92 0.39 . . . . 1.26 111.211 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 60.2 mttp -67.96 -44.88 75.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.213 -0.449 . . . . 1.54 110.039 177.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.4 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 79.1 mt -68.48 -22.57 27.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.456 0.646 . . . . 0.34000000000000002 110.614 177.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.14 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.791 0.805 . . . . 0.34999999999999998 109.744 177.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.46 -2.04 56.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.421 -1.263 . . . . 0.48999999999999999 110.397 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.9 tp -93.82 134.77 35.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.403 -0.817 . . . . 0.70999999999999996 110.114 -174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.39 155.41 40.18 Favored Glycine 0 C--O 1.225 -0.445 0 CA-C-O 119.669 -0.517 . . . . 0.76000000000000001 112.619 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -43.19 -43.21 10.06 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 124.072 3.182 . . . . 1.5600000000000001 114.49 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -66.22 -54.13 28.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.719 0.295 . . . . 2.52 110.265 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.67 -32.0 63.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.462 -0.495 . . . . 0.35999999999999999 110.59 -174.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.5 ttpt -61.53 -51.94 66.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 2.04 111.341 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.04 -34.62 89.55 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.356 -0.926 . . . . 0.40999999999999998 111.214 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.86 -49.1 64.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.029 -0.585 . . . . 1.6499999999999999 112.252 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.44 63.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.762 -0.654 . . . . 0.40999999999999998 111.753 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.75 -20.5 63.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.899 -0.591 . . . . 1.96 111.142 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 14.4 tppt? -90.22 -42.28 11.11 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.079 0.466 . . . . 2.1200000000000001 111.074 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -71.43 -43.78 66.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.99 0.424 . . . . 0.56999999999999995 110.998 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.471 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 77.9 mt -67.85 -30.37 48.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 1.0900000000000001 111.935 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 10.6 pt-20 -67.15 -28.73 68.37 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.15 -0.62 . . . . 2.8199999999999998 109.981 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.1 mt -67.29 -45.15 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 109.401 -0.592 . . . . 0.51000000000000001 109.401 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.25 -39.16 91.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.79 -0.641 . . . . 0.64000000000000001 110.604 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 19.1 mtm180 -68.41 -28.75 67.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.645 -0.707 . . . . 4.4199999999999999 110.617 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -73.78 -31.67 60.03 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.266 -0.492 . . . . 0.66000000000000003 112.351 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.16 -50.63 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.034 0.445 . . . . 0.55000000000000004 110.274 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.467 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 20.9 pttp -79.28 -7.71 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 2.7000000000000002 110.942 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.407 ' HA ' ' HD2' ' A' ' 100' ' ' TYR . . . -70.43 -33.76 71.7 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.425 -0.583 . . . . 0.63 109.425 168.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.633 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 78.6 mtp180 -85.44 -3.94 59.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.805 -0.634 . . . . 3.1000000000000001 110.0 175.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 20.5 m-85 -88.25 -32.21 18.64 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.988 -0.685 . . . . 0.96999999999999997 109.457 166.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.538 ' CE1' HD21 ' A' ' 22' ' ' LEU . 35.2 m-85 -69.6 -54.66 12.95 Favored 'General case' 0 N--CA 1.46 0.047 0 CA-C-O 121.022 0.439 . . . . 1.48 110.631 176.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.404 ' CG2' ' HB3' ' A' ' 37' ' ' PHE . 33.0 p -61.21 -26.92 68.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.273 0.842 . . . . 0.87 113.273 -172.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 103.47 -10.7 53.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.62 -0.8 . . . . 1.1599999999999999 112.141 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.633 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 91.5 m-20 -85.07 57.95 4.74 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.302 -0.258 . . . . 1.8300000000000001 110.302 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.93 125.61 18.26 Favored Pre-proline 0 N--CA 1.464 0.251 0 N-CA-C 112.797 0.666 . . . . 1.75 112.797 -172.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.33 142.75 30.56 Favored 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.811 2.341 . . . . 0.53000000000000003 111.324 175.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -78.18 169.47 18.21 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.493 -0.558 . . . . 1.48 109.493 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.416 ' NZ ' ' HB2' ' A' ' 107' ' ' LYS . 4.3 ttmp? -61.33 -34.59 75.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 118.26 0.482 . . . . 2.8799999999999999 110.648 -174.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -65.35 -30.21 71.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.798 -0.637 . . . . 2.2400000000000002 110.982 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -63.56 -40.21 96.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.246 0.546 . . . . 1.73 110.235 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.639 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -71.39 -42.42 68.41 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.515 -0.766 . . . . 0.81999999999999995 110.652 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -55.76 -42.73 75.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.094 0.473 . . . . 1.74 110.068 176.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.538 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -67.51 -39.08 85.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.854 -0.612 . . . . 0.46999999999999997 112.337 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.52 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 3.9 p -74.29 -33.31 63.21 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.436 0.532 . . . . 1.3400000000000001 112.436 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.703 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -74.3 -27.41 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 107.83 -1.174 . . . . 0.65000000000000002 107.83 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 23.0 ttmm -64.24 -35.42 80.78 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.882 -1.508 . . . . 1.72 110.775 177.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.442 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.5 mt-10 -77.02 -40.05 47.98 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.112 -0.635 . . . . 2.27 111.076 178.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 114' ' ' VAL . 5.5 m -66.79 -24.62 32.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.359 -0.536 . . . . 0.81000000000000005 110.229 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -84.19 -37.83 21.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.387 -0.37 . . . . 1.21 111.117 171.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 116' ' ' GLU . 36.5 ttpt -55.86 -44.12 77.77 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.297 -1.001 . . . . 0.94999999999999996 108.297 176.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.4 mp -69.25 -54.47 14.56 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 113.947 -1.478 . . . . 1.0600000000000001 111.867 174.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -69.37 -31.31 69.63 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 119.684 -0.806 . . . . 1.54 111.803 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -66.33 -28.44 68.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.848 0.356 . . . . 1.98 110.976 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.83 -3.36 58.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.167 0.803 . . . . 0.69999999999999996 113.167 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.0 mtm -77.4 158.18 30.2 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.851 -0.74 . . . . 0.5 110.663 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 34.6 t -66.18 149.73 49.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.796 -0.446 . . . . 1.1799999999999999 109.796 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -53.11 -43.75 67.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.603 0.24 . . . . 2.21 111.266 -176.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -70.02 -34.91 73.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.41999999999999998 110.973 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.5 -45.14 80.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.952 -0.567 . . . . 0.31 112.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -74.73 -24.97 58.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.328 . . . . 1.3200000000000001 110.485 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.86 -45.28 94.48 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.538 0.685 . . . . 0.41999999999999998 110.509 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.15 -28.93 63.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.859 -1.064 . . . . 0.55000000000000004 109.679 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -62.19 -30.05 70.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.324 -0.853 . . . . 0.39000000000000001 109.295 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.09 -7.24 88.58 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.664 -0.698 . . . . 0.27000000000000002 112.936 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -88.98 -40.98 12.64 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-O 121.342 0.591 . . . . 2.4300000000000002 110.155 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.457 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 44.2 mm-40 -85.98 -30.34 22.82 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.091 -0.959 . . . . 1.8300000000000001 110.57 -177.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.96 70.86 78.53 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.057 0.456 . . . . 0.68999999999999995 110.635 173.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.24 -27.28 72.21 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.953 2.435 . . . . 0.63 112.088 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 25.8 t80 -66.34 -39.49 89.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.799 -0.637 . . . . 2.3100000000000001 110.399 -178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.3 -42.11 17.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.105 -0.498 . . . . 1.02 110.793 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.81 -34.31 71.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.475 -0.565 . . . . 0.34999999999999998 109.475 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 28.6 tptp -50.5 -75.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.163 -0.926 . . . . 2.5800000000000001 111.633 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.461 HG21 ' HA ' ' A' ' 13' ' ' LEU . 1.5 m -63.68 -27.64 43.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.794 -0.639 . . . . 0.5 112.616 -172.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.79 -44.94 69.05 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.382 -0.527 . . . . 0.62 110.446 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -83.17 -27.27 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.401 -0.363 . . . . 2.5800000000000001 111.265 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 9.7 t -71.51 -19.59 62.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.927 0.394 . . . . 1.3200000000000001 110.67 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 102.74 -10.35 55.85 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.619 -0.801 . . . . 1.0900000000000001 112.583 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.547 ' HG3' HD21 ' A' ' 13' ' ' LEU . 46.2 tptt -54.55 -48.15 72.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.854 0.359 . . . . 1.98 110.79 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.408 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -75.36 -44.77 43.27 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.24 -0.436 . . . . 0.34000000000000002 110.922 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -56.13 -40.07 73.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.696 -0.684 . . . . 0.51000000000000001 112.611 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 4.8 mptp? -83.41 -16.55 45.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 2.8199999999999998 110.901 -177.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -78.81 -35.13 44.64 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.45 -0.574 . . . . 0.48999999999999999 109.45 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.703 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.58 -27.25 51.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.754 -0.657 . . . . 0.58999999999999997 110.955 176.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.289 0 C-N-CA 120.945 -0.645 . . . . 1.6200000000000001 111.958 -179.557 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.457 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 55.2 t80 . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 121.533 0.682 . . . . 1.47 112.179 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 4' ' ' GLU . 1.6 tmtm? -123.12 114.91 20.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.647 -0.706 . . . . 3.1499999999999999 109.21 177.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -68.35 -24.07 64.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.314 0.578 . . . . 2.3500000000000001 110.204 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 2' ' ' LYS . 44.8 mt-10 -86.1 -2.73 58.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.59 -0.732 . . . . 4.1600000000000001 110.394 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -94.08 -10.76 32.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.549 0.69 . . . . 2.5699999999999998 109.529 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.0 mt -80.74 131.6 60.16 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.345 -0.843 . . . . 0.68999999999999995 109.021 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -37.81 115.36 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.745 2.964 . . . . 0.59999999999999998 112.679 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.17 -17.78 64.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.56999999999999995 111.551 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -74.67 -26.58 59.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.92 0.867 . . . . 1.3700000000000001 109.299 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 65.4 t80 -85.13 -31.42 23.31 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.228 -1.351 . . . . 0.80000000000000004 110.656 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -67.88 -18.55 64.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.301 0.572 . . . . 1.73 110.028 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.71 -21.64 64.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.185 -0.916 . . . . 1.02 110.748 175.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.543 HD21 ' HD2' ' A' ' 147' ' ' LYS . 90.7 mt -87.4 -6.99 58.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.069 -0.514 . . . . 0.93000000000000005 110.916 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 63.6 mtt -86.75 126.98 61.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.341 -0.391 . . . . 1.1499999999999999 110.63 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -75.35 155.39 41.31 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.36 2.04 . . . . 0.90000000000000002 111.572 175.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.17 -49.37 7.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.577 2.851 . . . . 0.95999999999999996 113.492 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -51.36 -51.42 54.7 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.831 0.348 . . . . 1.8300000000000001 111.605 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.34 -28.18 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.809 0.337 . . . . 0.81999999999999995 111.405 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -76.55 -39.01 54.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.359 -0.382 . . . . 2.1600000000000001 110.465 178.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -46.71 -55.38 7.87 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.934 0.771 . . . . 1.0600000000000001 110.976 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' HB2' HD22 ' A' ' 66' ' ' LEU . 40.8 t80 -56.43 -63.39 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.673 -0.694 . . . . 0.65000000000000002 112.366 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -75.1 -5.36 43.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 119.223 0.92 . . . . 1.1299999999999999 111.72 -174.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -74.41 -37.49 63.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.008 0.432 . . . . 2.0600000000000001 110.377 162.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.37 -48.09 74.14 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.786 -0.643 . . . . 1.8400000000000001 111.717 -177.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.405 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.6 mm? -57.59 137.09 56.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.195 0.522 . . . . 1.05 110.578 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -131.58 -64.22 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.683 -0.689 . . . . 1.78 111.93 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 2.7 p-10 -135.76 -90.49 0.3 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.599 0.592 . . . . 2.3900000000000001 112.599 -173.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.402 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -62.54 -19.73 60.58 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 114.153 0.421 . . . . 0.93000000000000005 114.153 -171.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.574 ' O ' HG12 ' A' ' 32' ' ' VAL . 36.6 m-20 -76.82 -34.82 57.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.983 0.391 . . . . 2.25 110.93 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 1' ' ' PHE . 95.7 mttt -65.67 -27.38 68.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.524 0.678 . . . . 1.3100000000000001 110.487 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 66.0 m -60.71 -38.18 84.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.917 -1.038 . . . . 0.80000000000000004 111.246 176.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.623 HG21 ' HB3' ' A' ' 55' ' ' LYS . 6.2 p -89.91 -21.87 6.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.982 -0.554 . . . . 0.84999999999999998 111.581 -173.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.48 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 3.1 mm? -50.41 -50.91 50.46 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.804 0.298 . . . . 0.97999999999999998 111.804 172.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 9.2 ptpp? -65.72 -25.02 67.11 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.809 0.338 . . . . 2.4100000000000001 111.395 -176.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.55 -31.58 68.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.224 0.535 . . . . 1.96 109.891 176.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 89.7 t -74.71 -51.19 23.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.489 -0.778 . . . . 0.97999999999999998 110.19 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -53.69 -42.79 68.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.233 0.827 . . . . 0.82999999999999996 113.233 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.41 21.55 2.85 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.876 -0.73 . . . . 2.1800000000000002 111.023 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -122.11 12.38 10.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.827 -0.624 . . . . 1.5600000000000001 110.081 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.03 -156.82 10.41 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.71 -0.677 . . . . 1.54 112.19 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.69 165.12 84.61 Favored 'Cis proline' 0 C--N 1.343 0.281 0 C-N-CA 123.809 -1.33 . . . . 1.6799999999999999 112.981 0.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.462 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 54.7 m-85 -123.12 124.81 43.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.604 -0.725 . . . . 1.28 110.379 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -79.68 -20.53 46.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.211 -0.904 . . . . 3.5099999999999998 110.575 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.516 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.4 p30 -144.75 174.27 11.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.142 -0.481 . . . . 1.52 110.889 -171.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.1 m -72.06 -39.5 69.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.482 -0.326 . . . . 1.1799999999999999 111.091 -178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -59.05 -42.29 89.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.101 -0.499 . . . . 2.2400000000000002 111.751 -172.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.7 mt-10 -54.96 -39.57 69.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.802 0.334 . . . . 2.2599999999999998 111.485 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.7 m -72.71 -42.09 64.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.245 -0.434 . . . . 1.1899999999999999 110.442 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 60.7 mt -65.46 -38.33 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.55000000000000004 110.281 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.58 -52.51 64.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.375 -0.829 . . . . 0.56999999999999995 111.186 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.74 77.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.752 -0.658 . . . . 0.5 110.328 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.489 HD22 HD22 ' A' ' 59' ' ' LEU . 37.1 mt -70.3 -40.66 74.11 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.12 -0.946 . . . . 0.45000000000000001 111.41 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -66.52 -23.49 66.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.064 0.459 . . . . 1.22 111.26 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.33 -50.98 10.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 3.0499999999999998 109.92 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 51.7 mmtt -67.35 -62.21 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.784 -0.643 . . . . 1.48 111.909 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -132.33 90.8 33.14 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 116.043 -0.526 . . . . 1.1599999999999999 109.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -41.55 -57.51 1.43 Allowed 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.829 3.019 . . . . 0.57999999999999996 113.685 -171.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 30.5 tt0 -62.69 -27.03 68.97 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.234 -0.894 . . . . 2.4500000000000002 111.982 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 2.2 tt -70.79 -46.25 63.2 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.786 -1.19 . . . . 1.4199999999999999 107.786 -178.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.98 -32.07 83.02 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 114.407 -1.269 . . . . 0.37 111.318 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.43 91.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.666 0.269 . . . . 0.47999999999999998 110.457 174.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 61.7 mttp -54.54 -53.4 54.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.995 -0.548 . . . . 2.1699999999999999 110.125 175.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.503 HG22 ' CE1' ' A' ' 21' ' ' PHE . 1.8 t -65.25 -41.61 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.708 -0.678 . . . . 1.1200000000000001 111.02 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.39 -55.19 37.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.785 -0.643 . . . . 1.7 110.698 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 69' ' ' MET . 8.6 mtpm? -63.48 -41.14 98.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.343 0.592 . . . . 3.96 110.304 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 70' ' ' VAL . 16.4 tp -62.97 -50.59 70.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.331 -0.85 . . . . 1.5 112.298 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.6 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.3 p-80 -77.23 -17.23 58.62 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.881 -0.785 . . . . 2.3399999999999999 108.881 -172.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.0 81.12 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.625 -0.716 . . . . 0.40000000000000002 109.879 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 21.5 mtm -67.86 -46.85 70.56 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.281 -0.637 . . . . 0.71999999999999997 109.281 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 66' ' ' LEU . 2.3 m -62.13 -35.27 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.625 -0.716 . . . . 0.79000000000000004 109.832 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -65.42 -41.99 92.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.004 -0.544 . . . . 1.47 110.663 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 m -59.71 -29.72 68.3 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.197 0.523 . . . . 1.26 110.459 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 87.7 mttt -82.11 -47.01 13.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.557 -0.747 . . . . 1.54 110.837 177.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.9 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.34000000000000002 111.418 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.03 -31.12 71.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.475 0.655 . . . . 0.34999999999999998 110.274 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.47 58.69 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.836 -1.074 . . . . 0.48999999999999999 110.669 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.579 ' CD2' ' HA ' ' A' ' 132' ' ' PHE . 97.4 mt -43.59 140.39 1.8 Allowed 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 112.74 0.644 . . . . 0.70999999999999996 112.74 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 159.6 39.23 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.592 -1.003 . . . . 0.76000000000000001 110.592 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -43.5 -35.82 6.32 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.561 2.841 . . . . 1.5600000000000001 113.522 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.0 -48.35 37.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.523 -0.308 . . . . 2.52 111.15 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.439 ' HB1' HD22 ' A' ' 77' ' ' LEU . . . -72.41 -34.87 68.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.333 0.587 . . . . 0.35999999999999999 110.146 -174.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -58.38 -44.66 88.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.878 -1.055 . . . . 2.04 110.741 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.66 -43.97 97.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.167 -0.539 . . . . 0.40999999999999998 112.54 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -66.87 -44.09 81.83 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.529 0.204 . . . . 1.6499999999999999 110.951 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.69 -46.64 81.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.131 0.491 . . . . 0.40999999999999998 111.28 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 45.5 mt-10 -66.32 -42.43 88.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.66 -0.7 . . . . 1.96 110.529 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.09 -46.94 69.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.396 -0.366 . . . . 2.1200000000000001 111.134 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -60.39 -39.88 88.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.762 0.315 . . . . 0.56999999999999995 110.757 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.1 mt -65.5 -39.69 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 116.392 -0.367 . . . . 1.0900000000000001 110.818 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 54.4 mt-10 -56.62 -48.21 77.97 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.069 0.461 . . . . 2.8199999999999998 110.361 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 113' ' ' SER . 74.5 mt -64.59 -44.23 96.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.471 -0.786 . . . . 0.51000000000000001 110.892 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.6 66.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.05 0.452 . . . . 0.64000000000000001 110.941 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -62.89 -38.72 92.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.987 -0.551 . . . . 4.4199999999999999 110.78 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -71.74 -39.31 60.2 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.06 -0.591 . . . . 0.66000000000000003 113.065 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.41 -54.1 38.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.854 0.359 . . . . 0.55000000000000004 110.779 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.474 ' NZ ' ' HB2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -87.17 29.94 0.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 2.7000000000000002 110.07 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -112.83 -34.85 5.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.994 -1.003 . . . . 0.63 108.755 164.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -80.9 -13.38 58.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 3.1000000000000001 109.798 177.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 20.1 m-85 -77.38 -34.05 55.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.463 -0.569 . . . . 0.96999999999999997 109.463 167.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.48 ' CZ ' ' HG ' ' A' ' 33' ' ' LEU . 1.2 m-85 -77.83 -35.92 50.65 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.956 0.724 . . . . 1.48 112.956 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -65.04 -9.63 23.54 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.586 0.587 . . . . 0.87 112.586 -174.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.89 14.68 22.42 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.754 -0.736 . . . . 1.1599999999999999 111.531 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -117.88 -177.73 3.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.932 -0.396 . . . . 1.8300000000000001 109.932 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.451 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.4 mt-10 -142.52 105.19 5.45 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.318 -0.401 . . . . 1.75 110.729 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.1 Cg_endo -58.1 143.85 95.94 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.835 1.69 . . . . 0.53000000000000003 110.133 170.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.6 p -76.04 170.21 16.71 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.851 -0.426 . . . . 1.48 109.851 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.4 tptm -64.16 -30.37 71.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.136 -0.69 . . . . 2.8799999999999999 109.136 178.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -69.86 -30.11 67.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.373 -0.831 . . . . 2.2400000000000002 110.81 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -60.57 -46.28 90.81 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.801 -0.444 . . . . 1.73 109.801 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.5 mp -65.77 -44.94 84.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.529 -0.76 . . . . 0.81999999999999995 110.918 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 57.6 mtpt -59.41 -39.97 85.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.173 0.511 . . . . 1.74 110.445 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -69.4 -42.89 74.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.727 -0.669 . . . . 0.46999999999999997 111.413 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.421 ' HB2' HG22 ' A' ' 91' ' ' ILE . 51.2 p -61.79 -38.16 87.02 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.072 -0.251 . . . . 1.3400000000000001 111.558 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 117' ' ' VAL . 7.8 m -80.76 -25.83 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.395 0.617 . . . . 0.65000000000000002 109.447 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 41.1 ttmt -55.95 -44.56 78.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.701 -0.681 . . . . 1.72 110.994 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.511 ' O ' HD13 ' A' ' 120' ' ' LEU . 24.0 mt-10 -72.71 -34.21 66.98 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.271 -0.572 . . . . 2.27 111.006 -176.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.4 m -66.16 -34.03 67.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.144 -0.622 . . . . 0.81000000000000005 110.505 178.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 122' ' ' LYS . 4.1 mm? -73.19 -33.78 65.59 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.923 -0.486 . . . . 1.21 110.313 172.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 116' ' ' GLU . 35.4 ttpt -59.01 -45.64 90.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.996 -0.742 . . . . 0.94999999999999996 108.996 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -72.27 -49.9 31.29 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.663 -1.153 . . . . 1.0600000000000001 111.53 176.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.422 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 42.4 t80 -69.79 -37.47 76.33 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 119.849 -0.741 . . . . 1.54 111.747 -168.171 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.498 ' HE3' HD12 ' A' ' 118' ' ' LEU . 93.0 mttt -64.46 -29.88 70.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.931 0.396 . . . . 1.98 110.896 178.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.17 -6.68 59.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.69999999999999996 112.397 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.407 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 42.2 mtm -76.72 157.08 31.99 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.119 -0.633 . . . . 0.5 110.313 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 70.5 m -70.06 153.39 43.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 121.06 -0.256 . . . . 1.1799999999999999 110.705 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -54.97 -46.07 75.04 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.168 0.433 . . . . 2.21 112.168 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.7 75.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.775 0.322 . . . . 0.41999999999999998 111.076 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -68.14 -38.11 87.72 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.016 -0.538 . . . . 0.31 112.143 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.422 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 99.8 mttt -64.73 -46.39 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.323 0.582 . . . . 1.3200000000000001 110.154 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.05 -34.41 77.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.134 -0.939 . . . . 0.41999999999999998 111.443 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -74.18 -31.66 62.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.683 -0.488 . . . . 0.55000000000000004 109.683 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.579 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . 89.7 t80 -64.07 -34.45 78.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.777 -0.647 . . . . 0.39000000000000001 110.674 175.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.21 -4.91 57.79 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.133 -0.556 . . . . 0.27000000000000002 113.475 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -91.59 -23.14 19.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.567 0.699 . . . . 2.4300000000000002 110.088 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -108.81 -35.82 6.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.052 -0.976 . . . . 1.8300000000000001 110.889 -173.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -128.77 71.61 81.24 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.256 -0.646 . . . . 0.68999999999999995 109.256 171.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.88 -33.88 62.53 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.016 2.478 . . . . 0.63 112.75 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.621 ' O ' HG13 ' A' ' 142' ' ' VAL . 28.6 m-85 -65.98 -30.55 71.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.448 -0.342 . . . . 2.3100000000000001 111.492 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.4 ' HG ' ' CE1' ' A' ' 143' ' ' PHE . 5.9 mp -77.48 -48.23 17.63 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.399 -0.52 . . . . 1.02 110.028 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.16 -31.55 65.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.545 0.688 . . . . 0.34999999999999998 109.854 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 56.2 tttp -58.41 -75.09 0.05 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.804 -1.089 . . . . 2.5800000000000001 111.43 171.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.5 m -64.5 -26.68 40.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 112.895 0.702 . . . . 0.5 112.895 -172.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.4 ' CE1' ' HG ' ' A' ' 139' ' ' LEU . 3.8 m-85 -71.63 -47.89 51.52 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.682 -0.407 . . . . 0.62 110.478 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.24 -23.91 47.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 2.5800000000000001 111.188 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.7 t -70.71 -19.29 62.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.254 0.55 . . . . 1.3200000000000001 109.775 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.471 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 96.86 -9.62 66.01 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.973 -0.632 . . . . 1.0900000000000001 112.582 177.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.543 ' HD2' HD21 ' A' ' 13' ' ' LEU . 8.8 tmtm? -57.14 -50.7 71.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 1.98 110.408 -176.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.5 83.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.34000000000000002 111.092 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.97 80.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.126 -0.488 . . . . 0.51000000000000001 111.812 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 14.4 mmmm -75.36 -35.42 61.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.88 0.371 . . . . 2.8199999999999998 110.352 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.446 ' HD1' HG21 ' A' ' 114' ' ' VAL . 22.2 t80 -61.77 -40.57 95.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.48999999999999999 109.705 173.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.416 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -64.88 -42.37 94.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.602 -0.727 . . . . 0.58999999999999997 111.133 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.541 0 C-N-CA 120.731 -0.747 . . . . 1.6200000000000001 111.587 -175.772 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.0 p90 . . . . . 0 C--O 1.237 0.413 0 CA-C-O 121.525 0.678 . . . . 1.47 110.906 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -107.88 138.11 44.71 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.71 -0.677 . . . . 3.1499999999999999 109.584 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -70.72 -17.26 62.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.433 0.635 . . . . 2.3500000000000001 109.619 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -92.74 2.35 56.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.31 -0.859 . . . . 4.1600000000000001 110.127 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -106.38 -16.15 14.63 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.045 -0.525 . . . . 2.5699999999999998 110.134 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.6 mt -76.6 133.9 70.06 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 108.319 -0.993 . . . . 0.68999999999999995 108.319 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -43.06 116.2 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.298 2.665 . . . . 0.59999999999999998 112.875 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.74 -22.56 67.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.983 -0.553 . . . . 0.56999999999999995 111.491 -175.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.24 -34.45 78.04 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.129 0.966 . . . . 1.3700000000000001 108.925 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.427 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 64.5 t80 -85.37 -24.57 27.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.673 -1.603 . . . . 0.80000000000000004 110.49 -176.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -71.78 -20.46 61.86 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.401 0.62 . . . . 1.73 109.467 177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.61 -19.08 62.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.932 -1.031 . . . . 1.02 110.371 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' A' ' 147' ' ' LYS . 61.8 mt -96.39 12.98 29.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.593 -0.731 . . . . 0.93000000000000005 110.304 178.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 59.8 mtt -100.42 128.75 29.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.217 -0.447 . . . . 1.1499999999999999 110.604 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 21.0 Cg_endo -62.68 137.35 63.24 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.379 2.053 . . . . 0.90000000000000002 110.746 175.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.2 Cg_exo -50.49 -29.58 24.93 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.779 2.986 . . . . 0.95999999999999996 113.656 -175.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.517 ' O ' HD11 ' A' ' 66' ' ' LEU . 20.2 mp0 -64.54 -50.19 68.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.072 0.463 . . . . 1.8300000000000001 110.236 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.18 -29.59 69.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.554 . . . . 0.81999999999999995 110.796 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -68.55 -45.56 71.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.524 . . . . 2.1600000000000001 110.389 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.43 -41.13 65.74 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.45 0.469 . . . . 1.0600000000000001 111.436 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.555 ' O ' HD23 ' A' ' 25' ' ' LEU . 34.2 t80 -60.59 -68.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.849 -0.614 . . . . 0.65000000000000002 111.222 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.559 HD21 ' CE1' ' A' ' 100' ' ' TYR . 69.4 mt -70.01 -6.97 37.12 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 119.2 0.909 . . . . 1.1299999999999999 112.069 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.81 -53.19 50.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.518 0.199 . . . . 2.0600000000000001 110.801 163.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -81.0 -31.65 34.59 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.483 0.549 . . . . 1.8400000000000001 112.483 -173.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -56.41 131.12 47.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.711 0.767 . . . . 1.05 111.023 173.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.1 m -124.37 178.61 5.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.593 -1.185 . . . . 1.78 109.374 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.77 -47.29 64.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.798 0.333 . . . . 2.3900000000000001 111.644 -175.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.59 -48.75 79.3 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.959 -0.639 . . . . 0.93000000000000005 112.538 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.614 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.1 m-20 -65.89 -43.96 86.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.708 0.29 . . . . 2.25 110.999 -178.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.07 -17.58 57.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.438 -0.346 . . . . 1.3100000000000001 111.534 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.3 m -64.77 -43.64 92.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.454 0.645 . . . . 0.80000000000000004 109.888 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.614 HG12 ' O ' ' A' ' 29' ' ' ASP . 2.8 p -79.21 -29.69 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 CA-C-N 115.262 -0.881 . . . . 0.84999999999999998 110.082 -176.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.507 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.88 -42.41 72.04 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 121.044 0.45 . . . . 0.97999999999999998 110.167 169.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HA ' HG22 ' A' ' 101' ' ' THR . 63.3 tttp -62.99 -29.64 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 2.4100000000000001 111.019 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -77.99 -24.98 47.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.96 110.81 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.0 t -80.9 -57.2 5.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.717 0.77 . . . . 0.97999999999999998 110.009 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.412 ' HE1' HD12 ' A' ' 33' ' ' LEU . 17.8 m-85 -54.52 -42.55 70.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.652 -1.158 . . . . 0.82999999999999996 114.116 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.638 ' HE3' ' OG1' ' A' ' 101' ' ' THR . 5.1 mmpt? -86.1 8.27 21.48 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.966 -0.694 . . . . 2.1800000000000002 111.346 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -102.8 -77.98 0.55 Allowed 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.512 -0.767 . . . . 1.5600000000000001 108.975 169.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 44.56 -151.79 0.65 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.99 -0.624 . . . . 1.54 112.947 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -91.0 145.27 15.05 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 118.716 1.258 . . . . 1.6799999999999999 111.421 -8.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.439 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 22.7 m-85 -112.18 120.42 41.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.472 0.653 . . . . 1.28 111.35 -173.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -81.13 -19.2 44.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.822 -1.081 . . . . 3.5099999999999998 110.649 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.416 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -146.09 160.03 42.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.955 -0.566 . . . . 1.52 109.548 -174.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.457 ' O ' HG13 ' A' ' 49' ' ' ILE . 10.0 m -66.29 -30.57 71.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.231 -0.441 . . . . 1.1799999999999999 111.947 -174.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 41.0 tt0 -59.58 -39.45 84.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.968 -0.105 . . . . 2.2400000000000002 111.234 -177.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 43.7 mt-10 -60.55 -46.38 90.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.615 -0.266 . . . . 2.2599999999999998 111.311 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -65.76 -34.32 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 1.1899999999999999 110.919 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 45' ' ' THR . 88.6 mt -67.2 -41.79 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.55000000000000004 110.21 177.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.535 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -57.4 -51.76 68.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.56999999999999995 111.249 177.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.29 -42.56 77.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.5 110.511 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 18.7 mt -66.64 -39.09 88.11 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.45000000000000001 111.169 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -63.92 -31.02 72.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.22 111.03 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -73.99 -46.22 45.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.257 0.551 . . . . 3.0499999999999998 110.293 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 32' ' ' VAL . 61.0 mmtt -66.81 -59.0 3.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.526 -0.761 . . . . 1.48 111.737 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 m -140.65 101.98 6.54 Favored Pre-proline 0 C--N 1.311 -1.103 0 CA-C-O 121.274 0.559 . . . . 1.1599999999999999 109.564 -176.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -43.52 -47.97 8.91 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.32 3.347 . . . . 0.57999999999999996 112.798 -176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 11.7 pt-20 -62.86 -39.87 95.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.562 -1.199 . . . . 2.4500000000000002 112.558 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -72.22 -40.86 67.48 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.758 0.79 . . . . 1.4199999999999999 109.418 -172.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.08 -34.18 89.26 Favored Glycine 0 N--CA 1.441 -1.005 0 CA-C-N 114.427 -1.261 . . . . 0.37 111.62 176.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.53 -38.14 80.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.748 0.309 . . . . 0.47999999999999998 110.365 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.0 mmmt -58.01 -60.16 4.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.98 -0.555 . . . . 2.1699999999999999 110.697 177.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.14 -34.18 65.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 1.1200000000000001 111.309 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 49' ' ' ILE . 40.5 tt0 -57.88 -66.06 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.425 . . . . 1.7 111.237 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 69' ' ' MET . 55.5 mtmt -67.04 -32.35 73.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.381 0.61 . . . . 3.96 110.641 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.517 HD11 ' O ' ' A' ' 17' ' ' GLU . 1.4 tp -65.81 -47.03 76.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.21 -0.904 . . . . 1.5 111.196 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.05 -22.57 55.55 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.584 -0.895 . . . . 2.3399999999999999 108.584 -176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.23 68.67 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.022 -0.99 . . . . 0.40000000000000002 110.773 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 31.3 mtm -65.76 -46.99 76.71 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.635 -0.876 . . . . 0.71999999999999997 108.635 172.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.552 ' HA ' ' HD3' ' A' ' 73' ' ' LYS . 48.3 t -58.06 -44.16 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.446 -1.252 . . . . 0.79000000000000004 110.098 176.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -63.94 -39.81 95.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.321 -0.854 . . . . 1.47 110.339 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.8 t -58.97 -49.3 78.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.073 -0.512 . . . . 1.26 111.459 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -72.36 -36.27 68.72 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.056 -0.258 . . . . 1.54 111.017 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.417 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.9 mt -67.08 -30.23 48.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.085 0.469 . . . . 0.34000000000000002 110.676 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.43 -30.09 71.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.431 0.634 . . . . 0.34999999999999998 110.493 173.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.35 -4.5 59.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.277 -0.874 . . . . 0.48999999999999999 110.697 -178.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 135' ' ' GLN . 7.4 tp -91.12 139.73 30.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.372 -0.831 . . . . 0.70999999999999996 109.847 -176.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 155.61 53.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 0.76000000000000001 111.967 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -44.5 -38.87 12.36 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.824 3.016 . . . . 1.5600000000000001 113.835 -175.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -65.01 -57.02 9.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.116 0.484 . . . . 2.52 110.357 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -75.61 -32.37 60.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.35999999999999999 110.961 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.3 ttpt -59.72 -39.5 84.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.669 -0.696 . . . . 2.04 110.726 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.28 97.71 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.259 -0.972 . . . . 0.40999999999999998 111.527 177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.8 t80 -65.4 -41.94 93.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.566 0.222 . . . . 1.6499999999999999 111.134 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.38 -43.43 79.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.40999999999999998 111.038 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -84.72 -21.22 30.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.309 -0.405 . . . . 1.96 110.756 -177.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -73.61 -45.12 54.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.949 0.404 . . . . 2.1200000000000001 110.06 176.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.7 p -62.26 -34.21 76.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.231 -0.44 . . . . 0.56999999999999995 110.616 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.2 mt -68.77 -45.88 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.352 -0.386 . . . . 1.0900000000000001 111.782 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.15 -29.31 70.69 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.59 -0.444 . . . . 2.8199999999999998 110.922 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.9 mt -75.68 -44.9 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.15 0.5 . . . . 0.51000000000000001 109.937 175.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.423 ' O ' ' HD3' ' A' ' 96' ' ' LYS . . . -64.54 -31.2 72.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.829 -0.623 . . . . 0.64000000000000001 110.864 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -56.59 -51.89 66.93 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.092 -0.503 . . . . 4.4199999999999999 110.582 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.73 94.7 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.996 -0.621 . . . . 0.66000000000000003 112.961 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.8 mm -63.83 -52.85 51.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.342 . . . . 0.55000000000000004 111.095 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 100' ' ' TYR . 9.9 mptt -83.86 -13.29 53.99 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.311 -0.556 . . . . 2.7000000000000002 110.806 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.82 -24.94 67.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 118.327 0.512 . . . . 0.63 110.101 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.3 mtp180 -87.77 -24.84 23.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.074 -0.512 . . . . 3.1000000000000001 110.072 175.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -75.2 -37.97 60.95 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.96999999999999997 109.796 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.559 ' CE1' HD21 ' A' ' 22' ' ' LEU . 3.3 m-85 -52.85 -27.58 19.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.544 -0.753 . . . . 1.48 112.838 -176.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.638 ' OG1' ' HE3' ' A' ' 38' ' ' LYS . 17.5 p -131.05 32.96 4.23 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 118.427 -1.309 . . . . 0.87 113.273 -176.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 79.62 1.41 86.65 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.699 -0.763 . . . . 1.1599999999999999 114.003 170.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 90.4 m-20 -88.71 52.81 2.52 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.969 -0.752 . . . . 1.8300000000000001 108.969 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.505 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 34.3 mt-10 -53.1 115.41 7.45 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 114.469 -1.241 . . . . 1.75 113.395 -169.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 19.4 Cg_endo -64.61 154.07 74.12 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.859 2.373 . . . . 0.53000000000000003 111.178 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.454 HG23 ' H ' ' A' ' 108' ' ' ASP . 13.5 t -87.22 173.08 9.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.263 -0.643 . . . . 1.48 109.263 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -64.69 -22.91 67.09 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.224 -0.59 . . . . 2.8799999999999999 110.787 -175.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.454 ' H ' HG23 ' A' ' 106' ' ' THR . 18.2 m-20 -62.79 -44.16 96.91 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.175 -0.306 . . . . 2.2400000000000002 110.175 175.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -57.26 -44.23 83.71 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.304 0.573 . . . . 1.73 110.214 177.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.9 mp -68.04 -48.53 65.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.126 -0.943 . . . . 0.81999999999999995 111.213 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -63.94 -32.39 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.018 0.437 . . . . 1.74 110.211 -177.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.07 65.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.46999999999999997 111.423 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.0 p -62.49 -34.86 77.7 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.831 0.308 . . . . 1.3400000000000001 111.831 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 152' ' ' ALA . 2.7 m -84.49 -24.15 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.674 0.749 . . . . 0.65000000000000002 109.286 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -62.75 -42.77 99.83 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.126 -0.943 . . . . 1.72 111.28 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.578 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.8 mt-10 -69.1 -36.87 78.02 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 119.985 -0.686 . . . . 2.27 110.975 -178.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -66.12 -27.53 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.103 -0.639 . . . . 0.81000000000000005 109.844 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.489 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.0 mt -74.59 -37.81 62.79 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.693 -0.484 . . . . 1.21 109.693 172.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -57.83 -42.71 84.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.232 0.539 . . . . 0.94999999999999996 109.678 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.2 mm? -69.25 -49.79 53.03 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.343 -0.844 . . . . 1.0600000000000001 111.347 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 49.1 t80 -73.47 -29.36 62.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.907 -1.117 . . . . 1.54 111.665 -169.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -70.4 -38.92 74.72 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.588 -0.523 . . . . 1.98 109.588 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -92.15 68.85 5.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.514 0.673 . . . . 0.69999999999999996 110.985 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.56 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 41.8 mtm -147.77 152.4 37.66 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.978 -1.01 . . . . 0.5 109.325 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.4 m -66.55 140.36 57.97 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.293 -0.262 . . . . 1.1799999999999999 110.293 175.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -51.53 -42.14 61.56 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.401 0.519 . . . . 2.21 112.401 -168.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.46 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.958 0.355 . . . . 0.41999999999999998 111.958 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -82.5 -29.76 35.25 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.89 -0.671 . . . . 0.31 111.537 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -71.06 -47.78 56.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.024 0.44 . . . . 1.3200000000000001 110.29 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.8 65.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.83 -0.623 . . . . 0.41999999999999998 111.193 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.16 -31.12 60.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.267 -0.424 . . . . 0.55000000000000004 110.258 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -61.38 -27.69 68.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.761 -0.654 . . . . 0.39000000000000001 110.38 176.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.63 -13.31 78.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.066 -0.588 . . . . 0.27000000000000002 113.303 -178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -87.74 -39.95 14.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.736 0.779 . . . . 2.4300000000000002 109.536 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.423 ' HB2' HD13 ' A' ' 77' ' ' LEU . 2.0 mp0 -87.37 -36.11 17.97 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.662 -1.154 . . . . 1.8300000000000001 111.539 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -128.78 71.67 81.3 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 120.797 0.332 . . . . 0.68999999999999995 110.693 176.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -61.46 -40.51 47.49 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.906 2.404 . . . . 0.63 112.32 -176.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 60.5 t80 -62.46 -41.67 98.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 2.3100000000000001 111.276 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 85.4 mt -76.02 -42.13 48.89 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.639 -0.424 . . . . 1.02 110.383 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.51 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.23 0.538 . . . . 0.34999999999999998 110.05 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.6 tttt -49.63 -71.67 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.158 -0.928 . . . . 2.5800000000000001 111.481 171.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.5 m -64.3 -25.85 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.406 -0.815 . . . . 0.5 112.559 -171.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -71.27 -49.71 40.18 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 119.716 -0.794 . . . . 0.62 110.132 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -73.99 -34.3 64.14 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.298 -0.41 . . . . 2.5800000000000001 111.2 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.5 t -66.03 -19.54 65.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.223 -0.444 . . . . 1.3200000000000001 110.502 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.48 4.79 62.15 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.59 -0.814 . . . . 1.0900000000000001 112.232 178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' A' ' 13' ' ' LEU . 17.0 tptm -64.9 -51.07 63.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.813 0.339 . . . . 1.98 110.303 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.39 -40.39 81.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.01 0.433 . . . . 0.34000000000000002 110.223 177.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.489 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.91 -43.99 81.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.673 -0.694 . . . . 0.51000000000000001 111.554 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.94 -25.47 61.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.259 -0.428 . . . . 2.8199999999999998 111.504 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -74.36 -35.54 63.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.049 0.452 . . . . 0.48999999999999999 110.073 176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.646 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -81.39 -37.09 28.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 0.58999999999999997 112.017 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 110.297 -1.121 . . . . 1.6200000000000001 110.297 -169.265 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.9 p90 . . . . . 0 C--O 1.235 0.302 0 CA-C-O 120.875 0.369 . . . . 1.47 110.178 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.403 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 97.9 mttt -121.39 161.59 21.86 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.324 -0.235 . . . . 3.1499999999999999 110.396 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -54.22 -52.6 60.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 2.3500000000000001 111.598 -174.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.492 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 68.4 mm-40 -73.88 -0.13 15.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.621 0.6 . . . . 4.1600000000000001 112.621 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -91.99 -20.47 21.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 2.5699999999999998 110.407 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.35 138.69 74.89 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.556 -0.905 . . . . 0.68999999999999995 108.556 176.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -45.31 112.96 0.44 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.15 2.567 . . . . 0.59999999999999998 112.697 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.02 67.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.732 -0.667 . . . . 0.56999999999999995 111.471 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -65.25 -35.33 80.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 122.238 1.018 . . . . 1.3700000000000001 109.283 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.415 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 84.8 t80 -83.92 -28.43 27.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.119 -1.4 . . . . 0.80000000000000004 110.617 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 53.1 mtp180 -70.0 -18.73 63.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.556 0.693 . . . . 1.73 109.732 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -21.18 63.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.62 -1.173 . . . . 1.02 110.206 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.3 mt -94.05 -26.44 16.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.925 -0.58 . . . . 0.93000000000000005 110.636 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.8 mtt -62.22 124.93 84.31 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 1.1499999999999999 110.462 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.38 151.27 65.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.226 1.951 . . . . 0.90000000000000002 112.529 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.405 ' HD3' ' CD2' ' A' ' 138' ' ' PHE . 88.0 Cg_exo -48.89 -50.09 13.5 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 122.851 2.367 . . . . 0.95999999999999996 112.197 -177.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -77.21 42.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.924 -1.035 . . . . 1.8300000000000001 111.355 -178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -156.79 -38.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.022 -0.99 . . . . 0.81999999999999995 108.596 175.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -67.03 -32.09 73.07 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.34 -0.845 . . . . 2.1600000000000001 110.289 173.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -50.29 -46.91 55.57 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.766 0.666 . . . . 1.0600000000000001 111.477 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 43.1 t80 -58.43 -61.47 2.56 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 119.175 -0.44 . . . . 0.65000000000000002 111.589 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.52 HD21 ' HE1' ' A' ' 100' ' ' TYR . 32.2 mt -73.33 -9.4 58.66 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 119.614 1.097 . . . . 1.1299999999999999 112.254 -179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.61 -40.23 80.51 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.683 -0.488 . . . . 2.0600000000000001 109.683 163.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -72.34 -54.1 10.44 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.628 -0.714 . . . . 1.8400000000000001 110.881 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.6 mm? -53.94 126.58 22.95 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.434 0.635 . . . . 1.05 110.461 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -112.39 -73.59 0.66 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.027 -0.988 . . . . 1.78 111.17 -170.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 3.4 p-10 -140.03 -86.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.587 0.217 . . . . 2.3900000000000001 111.587 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.413 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -63.01 -14.17 51.7 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 121.475 -0.393 . . . . 0.93000000000000005 112.708 -178.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.0 OUTLIER -65.93 -38.07 87.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.286 0.565 . . . . 2.25 109.802 176.728 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.403 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 76.5 mttt -77.26 -9.31 58.72 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.443 0.64 . . . . 1.3100000000000001 110.732 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 91.3 m -63.78 -45.81 88.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.32 -0.854 . . . . 0.80000000000000004 109.801 172.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.598 HG12 ' O ' ' A' ' 29' ' ' ASP . 1.8 p -75.97 -32.77 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 114.837 -1.074 . . . . 0.84999999999999998 110.406 -173.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.584 HD13 HD21 ' A' ' 52' ' ' LEU . 4.5 mm? -53.55 -52.92 58.16 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.245 -0.434 . . . . 0.97999999999999998 111.443 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 7.7 ptpp? -66.78 -23.68 66.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.553 -0.294 . . . . 2.4100000000000001 111.573 -175.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.9 mm-40 -72.53 -31.09 65.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.578 0.228 . . . . 1.96 110.796 176.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.8 t -74.06 -53.06 18.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.966 0.888 . . . . 0.97999999999999998 109.758 174.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.3 m-85 -56.47 -42.13 77.71 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 114.628 1.344 . . . . 0.82999999999999996 114.628 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 34' ' ' LYS . 9.5 mtmp? -79.94 7.53 8.72 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.129 -0.628 . . . . 2.1800000000000002 111.197 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -103.1 -77.18 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.513 -0.767 . . . . 1.5600000000000001 109.531 170.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 48.55 -157.48 1.03 Allowed Glycine 0 CA--C 1.523 0.566 0 C-N-CA 120.902 -0.666 . . . . 1.54 112.964 -174.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 11.7 Cg_endo -91.31 139.69 10.64 Favored 'Cis proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.287 -1.13 . . . . 1.6799999999999999 111.288 -8.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 44.8 m-85 -110.07 112.24 24.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.5 0.667 . . . . 1.28 111.281 -173.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -72.71 -14.28 61.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.529 -1.214 . . . . 3.5099999999999998 111.808 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.462 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -145.19 151.78 38.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.814 0.34 . . . . 1.52 111.524 -173.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.7 m -77.97 64.38 3.17 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.919 0.866 . . . . 1.1799999999999999 110.122 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.462 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 28.0 tt0 -156.72 -43.54 0.07 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.9 -1.045 . . . . 2.2400000000000002 108.724 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.419 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.7 mm-40 -59.0 -38.89 80.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.416 -0.811 . . . . 2.2599999999999998 111.012 174.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 m -65.28 -39.56 92.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 1.1899999999999999 110.02 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.0 -42.1 91.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 0.55000000000000004 110.335 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.37 -49.62 73.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.788 -1.097 . . . . 0.56999999999999995 111.307 175.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.97 88.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.431 0.634 . . . . 0.5 110.294 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.584 HD21 HD13 ' A' ' 33' ' ' LEU . 36.6 mt -65.49 -41.53 93.16 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.16 -0.927 . . . . 0.45000000000000001 111.053 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.35 -38.22 83.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.898 0.38 . . . . 1.22 111.072 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -68.38 -40.86 81.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.599 -0.728 . . . . 3.0499999999999998 111.387 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HD2' HG22 ' A' ' 32' ' ' VAL . 39.3 mttm -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.862 0.363 . . . . 1.48 111.533 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -138.68 99.58 8.46 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.339 -0.615 . . . . 1.1599999999999999 109.339 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -46.3 -52.28 7.48 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.992 3.128 . . . . 0.57999999999999996 112.991 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.87 -34.56 78.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.94 -1.027 . . . . 2.4500000000000002 112.233 -178.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.8 mt -74.89 -39.67 61.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.103 -1.039 . . . . 1.4199999999999999 109.774 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.03 -39.0 96.08 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 114.76 -1.109 . . . . 0.37 111.549 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.3 89.3 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.125 -0.324 . . . . 0.47999999999999998 110.125 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -56.58 -57.38 12.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.581 -0.736 . . . . 2.1699999999999999 110.761 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -65.74 -30.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 1.1200000000000001 111.043 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.99 -60.46 3.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.399 -0.364 . . . . 1.7 110.964 178.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.39 -32.58 73.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.593 0.711 . . . . 3.96 110.213 -174.602 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.533 ' O ' HG23 ' A' ' 70' ' ' VAL . 8.4 tp -67.84 -45.57 74.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.993 -1.003 . . . . 1.5 111.818 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -79.99 -18.99 48.85 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.062 -0.718 . . . . 2.3399999999999999 109.062 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.99 85.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.004 -0.998 . . . . 0.40000000000000002 110.521 173.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.49 ' O ' ' HE2' ' A' ' 73' ' ' LYS . 30.8 mtm -59.47 -45.58 91.24 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.443 0.639 . . . . 0.71999999999999997 109.629 175.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 66' ' ' LEU . 60.8 t -56.04 -40.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.028 -0.987 . . . . 0.79000000000000004 110.548 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -67.27 -31.71 72.22 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.844 -0.616 . . . . 1.47 111.83 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.6 m -55.35 -41.93 73.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.009 0.433 . . . . 1.26 110.713 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 69' ' ' MET . 3.0 mmtt -71.06 -43.59 67.5 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 1.54 110.182 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 74.1 mt -70.63 -21.14 22.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.4 0.619 . . . . 0.34000000000000002 110.898 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.74 43.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.744 0.783 . . . . 0.34999999999999998 109.547 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 0.26 57.15 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.538 -1.21 . . . . 0.48999999999999999 110.324 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 77' ' ' LEU . 9.1 tp -93.07 133.04 36.63 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.70999999999999996 109.818 -175.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.16 158.86 50.35 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.998 -0.62 . . . . 0.76000000000000001 111.852 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.71 -34.99 22.38 Favored 'Trans proline' 0 N--CA 1.474 0.359 0 C-N-CA 123.611 2.874 . . . . 1.5600000000000001 113.798 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -65.33 -55.0 20.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.06 0.457 . . . . 2.52 110.187 -178.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.3 -29.54 38.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.628 -0.714 . . . . 0.35999999999999999 111.168 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.8 ttmt -56.5 -45.9 80.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.963 -0.562 . . . . 2.04 111.017 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.4 -42.07 98.79 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.792 -0.718 . . . . 0.40999999999999998 111.928 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 16.9 t80 -66.06 -44.62 84.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.196 . . . . 1.6499999999999999 111.12 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.1 79.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.389 -0.369 . . . . 0.40999999999999998 111.403 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 26.1 mt-10 -72.35 -35.31 68.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.813 -0.355 . . . . 1.96 110.744 -178.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -66.52 -50.31 63.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.238 -0.437 . . . . 2.1200000000000001 110.402 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.5 p -67.14 -38.92 86.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 0.56999999999999995 111.485 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.1 mp -57.23 -39.72 69.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.334 -0.394 . . . . 1.0900000000000001 111.205 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 63.6 mt-10 -72.31 -30.61 64.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.694 0.283 . . . . 2.8199999999999998 111.064 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.2 mt -74.59 -55.42 12.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.75 0.31 . . . . 0.51000000000000001 110.614 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.2 -50.24 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.944 -0.571 . . . . 0.64000000000000001 111.22 -178.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.99 -12.96 61.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.944 -0.571 . . . . 4.4199999999999999 110.971 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.73 -28.89 56.22 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.446 -0.662 . . . . 0.66000000000000003 111.446 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -62.7 -49.89 81.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.031 0.443 . . . . 0.55000000000000004 110.628 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.1 OUTLIER -83.1 4.08 27.9 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.258 -0.428 . . . . 2.7000000000000002 110.611 177.674 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.701 ' HA ' ' CD2' ' A' ' 100' ' ' TYR . . . -89.08 -33.95 16.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.175 -0.466 . . . . 0.63 110.03 172.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.415 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 5.7 ptp180 -86.85 5.46 36.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.407 -0.59 . . . . 3.1000000000000001 109.407 174.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -85.33 -37.72 19.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.304 -0.862 . . . . 0.96999999999999997 109.323 163.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.701 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 26.8 m-85 -57.36 -40.89 79.03 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.273 0.559 . . . . 1.48 111.201 -176.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.0 p -66.39 -8.31 24.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.055 -0.975 . . . . 0.87 112.687 -172.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 96.57 2.49 60.04 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.665 -0.778 . . . . 1.1599999999999999 111.265 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -95.43 171.01 8.96 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.356 -0.609 . . . . 1.8300000000000001 109.356 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -138.66 110.07 8.02 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 116.627 -0.26 . . . . 1.75 110.873 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.415 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 19.5 Cg_endo -61.72 143.22 96.15 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.284 1.989 . . . . 0.53000000000000003 111.002 173.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.456 ' O ' HD13 ' A' ' 110' ' ' LEU . 48.3 p -75.97 165.27 25.22 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.669 -0.493 . . . . 1.48 109.669 178.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -64.18 -22.39 66.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.861 -0.736 . . . . 2.8799999999999999 109.972 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 111' ' ' LYS . 38.2 m-20 -72.83 -35.68 67.33 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.23 -0.441 . . . . 2.2400000000000002 110.365 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -60.51 -42.3 96.11 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.253 -0.647 . . . . 1.73 109.253 173.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 106' ' ' THR . 7.1 mp -65.23 -46.73 79.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 114.987 -1.006 . . . . 0.81999999999999995 110.704 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 108' ' ' ASP . 50.1 mtpt -55.47 -48.24 74.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.347 -0.388 . . . . 1.74 110.558 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.431 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -62.37 -42.38 99.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.46999999999999997 111.455 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.497 ' O ' HG13 ' A' ' 117' ' ' VAL . 81.1 p -62.02 -38.59 89.25 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.312 0.486 . . . . 1.3400000000000001 112.312 -176.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.566 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.7 m -83.21 -23.39 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 122.031 0.92 . . . . 0.65000000000000002 109.454 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' HB1' ' A' ' 152' ' ' ALA . 36.8 ttpt -68.44 -48.74 63.78 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.451 -1.249 . . . . 1.72 111.185 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.54 ' O ' HD23 ' A' ' 120' ' ' LEU . 7.8 mm-40 -65.21 -35.91 82.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 2.27 110.829 -177.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -68.12 -26.86 35.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.662 -0.415 . . . . 0.81000000000000005 110.269 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.546 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 73.8 mt -73.44 -37.73 65.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.537 -0.542 . . . . 1.21 109.537 171.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.5 ttpt -57.11 -46.41 82.64 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 109.197 -0.668 . . . . 0.94999999999999996 109.197 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.3 mm? -63.21 -55.36 25.67 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.496 -0.774 . . . . 1.0600000000000001 111.68 170.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 17.5 t80 -67.86 -36.04 79.6 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 119.626 -0.83 . . . . 1.54 111.936 -166.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -64.11 -25.07 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.668 0.271 . . . . 1.98 111.464 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -93.45 -5.14 49.92 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.633 0.605 . . . . 0.69999999999999996 112.633 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.473 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 51.5 mtm -74.7 157.39 35.37 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.1 -0.64 . . . . 0.5 111.21 -178.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 3.6 m -59.78 151.79 24.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.167 -0.469 . . . . 1.1799999999999999 110.134 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -61.38 -40.71 95.33 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.726 -0.389 . . . . 2.21 110.757 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.96 74.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.381 . . . . 0.41999999999999998 110.683 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.66 -36.84 67.46 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 0.31 111.558 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' A' ' 124' ' ' MET . 96.6 mttt -66.08 -43.95 85.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.13 0.49 . . . . 1.3200000000000001 110.391 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.4 -35.92 81.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.41999999999999998 111.346 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.481 ' OD1' ' HD2' ' A' ' 134' ' ' LYS . 35.9 t70 -74.71 -27.97 60.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.268 0.556 . . . . 0.55000000000000004 110.069 -176.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.79 -30.63 71.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.078 -0.51 . . . . 0.39000000000000001 110.158 171.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.453 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -70.21 -26.02 74.82 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.27000000000000002 113.929 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.481 ' HD2' ' OD1' ' A' ' 131' ' ' ASP . 15.1 ptpt -85.86 -32.12 21.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.256 0.55 . . . . 2.4300000000000002 111.235 -178.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.413 ' CG ' HD13 ' A' ' 77' ' ' LEU . 36.2 mm-40 -88.17 -41.78 12.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.676 -0.693 . . . . 1.8300000000000001 110.658 -178.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.37 75.63 61.51 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-O 120.876 0.369 . . . . 0.68999999999999995 110.465 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -62.68 -41.73 29.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.166 2.578 . . . . 0.63 112.713 -174.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.497 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 46.2 t80 -58.29 -44.8 88.67 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.151 -0.477 . . . . 2.3100000000000001 111.1 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.79 -42.27 50.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.422 -0.353 . . . . 1.02 110.878 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.453 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.63 -40.75 84.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.34999999999999998 109.94 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 85.9 tttt -46.83 -68.43 0.19 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.947 -1.024 . . . . 2.5800000000000001 111.26 172.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.429 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.0 m -62.83 -28.55 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.646 -0.706 . . . . 0.5 112.637 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -73.09 -49.75 26.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.017 -0.673 . . . . 0.62 110.633 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.4 -32.54 66.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.596 -0.275 . . . . 2.5800000000000001 111.463 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.4 t -71.4 -26.68 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.198 0.523 . . . . 1.3200000000000001 110.52 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.05 7.02 56.66 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.604 -0.808 . . . . 1.0900000000000001 112.226 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -63.35 -48.95 75.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.911 0.386 . . . . 1.98 110.554 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.0 -34.97 71.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.34000000000000002 110.091 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.546 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -58.58 -54.25 49.15 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.57 -0.741 . . . . 0.51000000000000001 110.466 177.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.34 -41.76 63.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 2.8199999999999998 111.374 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -55.7 -46.2 77.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.48999999999999999 111.269 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.511 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.17 -10.0 55.55 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.925 0.713 . . . . 0.58999999999999997 112.925 -176.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 C-N-CA 120.15 -1.024 . . . . 1.6200000000000001 110.845 -172.783 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.742 ' HA ' ' OE1' ' A' ' 4' ' ' GLU . 50.9 t80 . . . . . 0 C--O 1.223 -0.339 0 CA-C-O 121.286 0.565 . . . . 1.47 111.514 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -102.57 38.67 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.688 . . . . 3.1499999999999999 109.527 178.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.637 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 0.4 OUTLIER 58.09 22.2 8.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.04 -1.467 . . . . 2.3500000000000001 107.04 -159.117 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.742 ' OE1' ' HA ' ' A' ' 1' ' ' PHE . 12.0 mm-40 40.92 28.48 0.05 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 112.623 -2.08 . . . . 4.1600000000000001 115.076 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 43.08 34.19 0.62 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.209 0.528 . . . . 2.5699999999999998 110.733 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 3' ' ' TYR . 99.7 mt -53.29 134.44 51.57 Favored Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 115.887 -0.597 . . . . 0.68999999999999995 111.405 -174.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -36.23 113.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.035 3.157 . . . . 0.59999999999999998 112.694 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.07 -15.82 57.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.56 -0.746 . . . . 0.56999999999999995 111.227 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.97 -34.41 77.7 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.243 1.02 . . . . 1.3700000000000001 108.903 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -88.81 -33.09 17.54 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 113.58 -1.646 . . . . 0.80000000000000004 111.122 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.438 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 32.3 mtm180 -68.61 -27.79 66.34 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.25 -0.648 . . . . 1.73 109.25 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.39 -36.15 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.16 -0.927 . . . . 1.02 110.594 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.66 -36.06 60.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.627 -0.715 . . . . 0.93000000000000005 110.356 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 71.5 mtm -67.74 133.53 92.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.872 -0.603 . . . . 1.1499999999999999 111.41 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.45 ' HB2' ' OE2' ' A' ' 17' ' ' GLU . 72.2 Cg_endo -76.99 163.83 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.577 2.185 . . . . 0.90000000000000002 112.075 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.59 -44.23 17.49 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 123.085 2.523 . . . . 0.95999999999999996 113.229 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.1 pm0 -71.79 9.23 0.94 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.752 0.649 . . . . 1.8300000000000001 112.752 -176.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.06 -21.76 4.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.913 0.387 . . . . 0.81999999999999995 110.736 172.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 63.9 mtp180 -91.89 -44.48 8.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.043 -0.526 . . . . 2.1600000000000001 110.625 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 13.3 t70 -50.15 -50.9 47.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.544 -0.753 . . . . 1.0600000000000001 111.253 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.559 ' O ' HD23 ' A' ' 25' ' ' LEU . 41.1 t80 -52.56 -62.14 1.83 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.65000000000000002 111.799 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 1' ' ' PHE . 13.0 mt -74.59 -6.95 51.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 118.667 0.667 . . . . 1.1299999999999999 111.05 -175.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.44 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 61.0 tp60 -75.36 -43.27 51.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.17 0.51 . . . . 2.0600000000000001 110.739 163.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -64.97 -47.63 76.9 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.583 -0.735 . . . . 1.8400000000000001 111.842 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.559 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.7 mm? -53.34 132.72 39.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.48 0.657 . . . . 1.05 110.435 177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -114.1 -72.23 0.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.984 -1.007 . . . . 1.78 112.083 -173.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -140.11 -82.95 0.25 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.624 -0.43 . . . . 2.3900000000000001 111.802 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.81 -29.89 71.47 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 121.464 -0.398 . . . . 0.93000000000000005 113.395 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.43 -6.83 50.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.812 0.339 . . . . 2.25 111.12 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.545 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 92.4 mttt -89.48 -24.81 21.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.228 0.537 . . . . 1.3100000000000001 109.864 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.5 m -62.34 -33.68 75.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.309 -0.86 . . . . 0.80000000000000004 111.008 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.681 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 4.4 p -75.38 -32.11 25.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.537 -0.301 . . . . 0.84999999999999998 111.713 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.425 HD12 ' CE2' ' A' ' 37' ' ' PHE . 4.0 mm? -49.88 -51.87 37.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.867 0.321 . . . . 0.97999999999999998 111.867 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 63.6 pttt -64.25 -33.04 74.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.758 0.313 . . . . 2.4100000000000001 110.832 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -65.86 -24.7 66.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.509 . . . . 1.96 110.735 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -91.98 -44.43 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.992 -0.549 . . . . 0.97999999999999998 110.587 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 33' ' ' LEU . 18.9 m-85 -55.14 -34.49 63.81 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.748 0.647 . . . . 0.82999999999999996 112.748 173.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -93.15 7.64 43.42 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.087 -0.645 . . . . 2.1800000000000002 110.921 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.57 12.23 22.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.975 -0.557 . . . . 1.5600000000000001 110.375 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.85 -158.48 19.44 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.88 -0.676 . . . . 1.54 112.181 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.64 163.58 87.93 Favored 'Cis proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.935 -1.277 . . . . 1.6799999999999999 112.754 0.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.571 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 45.9 m-85 -121.57 134.78 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.186 -0.915 . . . . 1.28 109.599 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -81.02 -12.02 59.44 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.872 -0.604 . . . . 3.5099999999999998 110.482 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -161.0 165.03 30.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.703 -0.681 . . . . 1.52 110.191 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.9 m -64.62 -29.59 70.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.222 0.326 . . . . 1.1799999999999999 111.09 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -53.1 -43.85 67.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.086 -0.506 . . . . 2.2400000000000002 111.402 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.571 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 29.5 mt-10 -59.43 -42.11 91.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.201 -0.454 . . . . 2.2599999999999998 111.215 177.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.6 t -66.32 -39.62 89.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.32 -0.4 . . . . 1.1899999999999999 110.158 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.81 -41.98 93.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.54 . . . . 0.55000000000000004 110.19 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.9 -50.09 74.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.164 -0.926 . . . . 0.56999999999999995 111.286 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.94 -39.58 74.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.5 110.771 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 29.9 mt -69.24 -40.23 78.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.636 -0.711 . . . . 0.45000000000000001 111.03 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -63.38 -31.16 72.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.774 0.321 . . . . 1.22 111.779 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.82 -38.16 70.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.176 -0.465 . . . . 3.0499999999999998 111.061 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.681 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 5.2 tppt? -85.8 -56.02 3.69 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.994 0.426 . . . . 1.48 110.835 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.9 m -127.57 90.72 47.63 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.854 -0.612 . . . . 1.1599999999999999 109.515 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.66 -55.41 3.58 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 124.31 3.34 . . . . 0.57999999999999996 113.196 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -63.54 -32.96 74.57 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 114.603 -1.18 . . . . 2.4500000000000002 112.084 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.7 -39.63 66.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.049 0.928 . . . . 1.4199999999999999 108.759 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.82 88.3 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.124 -1.398 . . . . 0.37 111.436 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.32 -32.24 72.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.817 0.341 . . . . 0.47999999999999998 110.662 175.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -66.96 -51.87 49.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 2.1699999999999999 110.908 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.94 -24.23 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 120.851 0.358 . . . . 1.1200000000000001 110.684 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -65.1 -59.29 4.28 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.257 -0.429 . . . . 1.7 110.792 177.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -34.84 77.63 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.534 0.683 . . . . 3.96 109.444 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 17' ' ' GLU . 18.0 tp -67.62 -30.35 69.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.691 -1.14 . . . . 1.5 110.657 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -83.58 -37.0 23.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 109.083 -0.71 . . . . 2.3399999999999999 109.083 -177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.92 83.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.039 -0.982 . . . . 0.40000000000000002 110.354 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 17' ' ' GLU . 31.9 mtp -53.6 -57.96 8.88 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.354 0.597 . . . . 0.71999999999999997 110.363 173.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 66' ' ' LEU . 82.9 t -56.07 -44.85 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 114.794 -1.094 . . . . 0.79000000000000004 110.881 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -64.63 -42.44 95.47 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 116.053 -0.522 . . . . 1.47 111.698 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.9 m -59.21 -35.26 73.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.168 0.509 . . . . 1.26 110.89 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 88.7 mttt -78.1 -46.7 20.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.729 -0.669 . . . . 1.54 110.552 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.2 mt -66.25 -17.22 22.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 121.844 0.83 . . . . 0.34000000000000002 110.379 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.16 -34.72 56.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.986 -1.006 . . . . 0.34999999999999998 110.035 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -85.35 -1.32 56.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.811 -1.086 . . . . 0.48999999999999999 110.17 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 132' ' ' PHE . 7.8 tp -96.57 138.64 33.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.544 -0.753 . . . . 0.70999999999999996 110.417 -175.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.56 152.8 52.44 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.72 -0.752 . . . . 0.76000000000000001 111.934 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -41.15 -44.99 5.42 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 124.392 3.395 . . . . 1.5600000000000001 114.368 -176.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 80' ' ' GLU . 1.0 OUTLIER -69.19 -44.31 72.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 2.52 111.239 -175.846 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.436 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -77.29 -32.52 55.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.553 0.692 . . . . 0.35999999999999999 109.817 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -52.33 -51.62 57.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.373 -1.285 . . . . 2.04 111.651 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.84 -40.8 95.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.014 -0.612 . . . . 0.40999999999999998 112.363 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 14.6 t80 -68.98 -44.1 73.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.391 0.139 . . . . 1.6499999999999999 110.883 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -58.05 -37.33 74.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.977 0.418 . . . . 0.40999999999999998 111.046 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 44.2 mt-10 -68.14 -48.33 65.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.059 -0.519 . . . . 1.96 110.279 178.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 91' ' ' ILE . 47.2 mttm -66.05 -44.19 85.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.346 0.498 . . . . 2.1200000000000001 112.346 -178.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.404 ' HA ' HG12 ' A' ' 117' ' ' VAL . 11.8 p -59.79 -45.85 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.86 0.362 . . . . 0.56999999999999995 110.998 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.6 mp -60.36 -41.88 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.013 -0.539 . . . . 1.0900000000000001 110.648 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 46.4 mt-10 -64.24 -52.83 56.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.654 0.242 . . . . 2.8199999999999998 111.654 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.515 HG22 ' OG ' ' A' ' 113' ' ' SER . 70.6 mt -60.51 -43.85 95.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 120.868 0.366 . . . . 0.51000000000000001 111.279 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.4 -46.24 73.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.079 0.466 . . . . 0.64000000000000001 111.17 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -68.65 -25.97 65.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.445 -0.343 . . . . 4.4199999999999999 111.781 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.64 -36.3 75.7 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.852 -0.69 . . . . 0.66000000000000003 112.024 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 mm -58.91 -41.32 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.009 0.433 . . . . 0.55000000000000004 111.145 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.491 ' HD3' ' N ' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -96.5 17.88 15.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.117 0.484 . . . . 2.7000000000000002 110.707 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -102.22 -34.54 9.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.604 -0.725 . . . . 0.63 109.06 169.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 8.1 ptm180 -83.63 -3.23 57.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 3.1000000000000001 109.954 174.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.511 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -80.27 -40.08 27.64 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.491 -0.559 . . . . 0.96999999999999997 109.491 164.396 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.413 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 2.9 m-85 -68.56 -32.44 72.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.605 -0.725 . . . . 1.48 111.985 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.3 p -65.46 -15.08 62.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.87 112.06 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 107.68 10.68 26.42 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 121.11 -0.567 . . . . 1.1599999999999999 111.816 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 87.5 m-20 -108.53 169.22 8.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.882 -0.414 . . . . 1.8300000000000001 109.882 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.7 mt-10 -133.15 104.83 12.43 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 121.19 -0.204 . . . . 1.75 111.302 177.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.8 Cg_endo -60.38 139.53 87.08 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 121.744 1.63 . . . . 0.53000000000000003 110.647 171.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.449 HG22 ' OD2' ' A' ' 109' ' ' ASP . 11.4 t -83.97 176.64 8.72 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.799 -0.445 . . . . 1.48 109.799 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.6 pptp? -63.81 -25.79 68.33 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.511 -0.476 . . . . 2.8799999999999999 110.644 -176.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.87 -35.44 80.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.903 -0.59 . . . . 2.2400000000000002 110.01 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.449 ' OD2' HG22 ' A' ' 106' ' ' THR . 20.6 m-20 -63.96 -45.69 88.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 1.73 110.587 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -66.38 -43.89 84.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.81999999999999995 110.58 178.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 23.9 ttmm -59.38 -42.95 92.87 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.193 -0.458 . . . . 1.74 110.426 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 116' ' ' GLU . . . -68.01 -42.41 80.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.471 -0.332 . . . . 0.46999999999999997 110.838 177.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.515 ' OG ' HG22 ' A' ' 91' ' ' ILE . 42.2 t -53.06 -50.26 64.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 1.3400000000000001 111.096 178.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' A' ' 152' ' ' ALA . 3.8 m -77.97 -26.24 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-O 121.534 0.683 . . . . 0.65000000000000002 109.639 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 62.9 tttm -60.44 -42.33 95.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.368 -0.833 . . . . 1.72 111.074 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 112' ' ' ALA . 29.8 mt-10 -73.39 -37.71 65.88 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.6 -0.44 . . . . 2.27 110.502 -177.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.73 -34.5 70.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.502 -0.479 . . . . 0.81000000000000005 110.39 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.532 HD23 ' O ' ' A' ' 114' ' ' VAL . 4.0 mm? -71.64 -35.24 70.33 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.062 -0.399 . . . . 1.21 110.225 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -59.31 -40.75 87.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.956 -0.757 . . . . 0.94999999999999996 108.956 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -71.9 -53.71 12.3 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.228 -0.896 . . . . 1.0600000000000001 111.792 172.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 72.2 t80 -69.53 -37.04 76.95 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 119.916 -0.714 . . . . 1.54 111.914 -165.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -68.66 -28.57 67.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 1.98 110.987 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.32 56.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 0.69999999999999996 112.136 -176.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 36.6 mtm -74.96 160.15 30.93 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.546 -0.461 . . . . 0.5 111.342 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.0 t -60.05 137.05 58.18 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.011 -0.737 . . . . 1.1799999999999999 109.011 172.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.5 -39.51 73.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.561 -0.745 . . . . 2.21 111.691 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.59 87.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.41999999999999998 110.606 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.78 66.33 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.639 -0.71 . . . . 0.31 111.46 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 129' ' ' LYS . 44.3 mtpt -64.96 -45.98 83.47 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.378 0.608 . . . . 1.3200000000000001 109.714 176.077 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.59 78.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.387 -0.824 . . . . 0.41999999999999998 110.529 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.405 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 38.2 t70 -74.16 -33.91 63.64 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.381 -0.6 . . . . 0.55000000000000004 109.381 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.486 ' HA ' HD11 ' A' ' 77' ' ' LEU . 82.6 t80 -62.31 -32.39 73.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.735 -0.666 . . . . 0.39000000000000001 110.343 171.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -70.39 -7.63 60.94 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.27000000000000002 112.945 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 79.2 mttt -88.94 -43.45 11.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.361 0.601 . . . . 2.4300000000000002 109.596 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.525 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.7 mp0 -86.34 -35.75 19.67 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.17 -0.923 . . . . 1.8300000000000001 111.304 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -133.95 74.8 68.11 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.218 0.532 . . . . 0.68999999999999995 110.441 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.92 -31.74 66.68 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 123.243 2.628 . . . . 0.63 112.926 -174.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' HG13 ' A' ' 142' ' ' VAL . 34.9 m-85 -61.88 -44.82 96.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.065 0.394 . . . . 2.3100000000000001 112.065 -177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.404 HD21 ' HD3' ' A' ' 15' ' ' PRO . 65.6 mt -72.27 -43.72 63.88 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.506 -0.478 . . . . 1.02 110.191 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.25 -31.51 67.48 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.481 0.657 . . . . 0.34999999999999998 110.451 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 25.4 ttmm -61.54 -76.94 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.094 -0.957 . . . . 2.5800000000000001 111.664 173.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.553 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.0 OUTLIER -63.9 -24.35 35.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.173 -0.921 . . . . 0.5 112.636 -169.547 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -70.82 -41.62 71.32 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.799 -0.36 . . . . 0.62 110.47 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -81.6 -25.22 35.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.455 . . . . 2.5800000000000001 110.96 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.8 m -69.67 -8.72 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.03 0.443 . . . . 1.3200000000000001 110.513 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 88.64 -4.06 85.06 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.901 -0.591 . . . . 1.0900000000000001 113.099 175.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -69.12 -53.94 17.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.731 0.301 . . . . 1.98 111.193 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.406 ' HB1' HD21 ' A' ' 118' ' ' LEU . . . -65.0 -39.64 93.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.409 -0.36 . . . . 0.34000000000000002 110.603 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.44 -42.76 88.07 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.158 -0.474 . . . . 0.51000000000000001 110.512 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -62.5 -41.7 99.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.826 0.346 . . . . 2.8199999999999998 110.372 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -62.71 -34.86 78.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.942 -0.572 . . . . 0.48999999999999999 110.332 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.558 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.48 -34.24 41.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.58999999999999997 111.946 -178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 111.22 -0.752 . . . . 1.6200000000000001 111.22 -174.923 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.467 ' CE1' ' HG3' ' A' ' 30' ' ' LYS . 18.6 p90 . . . . . 0 C--O 1.235 0.318 0 CA-C-O 121.142 0.496 . . . . 1.47 111.435 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.527 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 68.5 mttm -118.09 157.0 27.67 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.745 -0.662 . . . . 3.1499999999999999 109.733 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -66.64 -18.08 65.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.464 0.649 . . . . 2.3500000000000001 109.736 175.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -84.24 -14.65 49.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.313 -0.858 . . . . 4.1600000000000001 110.847 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.527 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 5.5 m-20 -93.66 -6.03 47.28 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.294 0.569 . . . . 2.5699999999999998 110.414 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.1 mt -85.49 135.41 38.59 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.325 -0.852 . . . . 0.68999999999999995 108.952 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -46.24 114.26 0.81 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.199 2.599 . . . . 0.59999999999999998 112.583 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.97 67.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.56999999999999995 111.713 -176.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -63.86 -36.32 83.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.897 0.856 . . . . 1.3700000000000001 109.556 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -88.27 -19.03 27.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.097 -1.411 . . . . 0.80000000000000004 110.618 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -74.53 -25.49 59.37 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.502 0.668 . . . . 1.73 109.557 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.604 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 27.5 t70 -67.16 -25.16 66.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.066 -0.97 . . . . 1.02 110.36 173.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.445 HD21 ' HG3' ' A' ' 147' ' ' LYS . 98.2 mt -87.3 7.68 27.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.93000000000000005 111.013 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.536 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 67.1 mtt -93.79 122.06 63.09 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.452 -0.34 . . . . 1.1499999999999999 110.143 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.2 150.35 84.96 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.286 1.991 . . . . 0.90000000000000002 111.159 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -45.87 -45.19 17.53 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.009 2.473 . . . . 0.95999999999999996 113.246 -172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.89 -50.43 73.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.952 0.406 . . . . 1.8300000000000001 111.134 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.7 -37.08 70.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.81999999999999995 111.836 -174.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.536 ' HD2' ' O ' ' A' ' 14' ' ' MET . 14.0 ptm180 -76.91 -29.17 55.6 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 121.019 -0.273 . . . . 2.1600000000000001 111.071 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.49 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 27.9 t70 -56.39 -45.38 80.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.712 0.292 . . . . 1.0600000000000001 110.553 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 50.2 t80 -55.58 -60.35 3.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.07 -0.514 . . . . 0.65000000000000002 111.823 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.499 HD21 ' CE1' ' A' ' 100' ' ' TYR . 23.1 mt -73.45 -8.11 54.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 119.791 1.178 . . . . 1.1299999999999999 112.045 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 28.1 tt0 -69.07 -38.7 79.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.086 0.469 . . . . 2.0600000000000001 109.875 163.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -72.15 -54.23 10.32 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.808 -0.633 . . . . 1.8400000000000001 110.349 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -54.12 130.62 38.86 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.227 -0.897 . . . . 1.05 111.115 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 m -129.96 -82.34 0.55 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.508 -0.769 . . . . 1.78 110.994 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.54 154.59 43.03 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.546 -0.538 . . . . 2.3900000000000001 109.546 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -45.76 3.52 Favored Glycine 0 C--N 1.322 -0.225 0 C-N-CA 120.462 -0.875 . . . . 0.93000000000000005 111.694 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.51 -29.74 69.23 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 2.25 109.534 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HE3' ' HB3' ' A' ' 25' ' ' LEU . 1.5 mptm? -62.44 -18.07 60.85 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.008 -0.542 . . . . 1.3100000000000001 110.361 176.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.4 m -74.4 -45.48 46.45 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.757 -0.656 . . . . 0.80000000000000004 110.318 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.77 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 2.3 p -73.17 -41.77 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 120.281 -0.567 . . . . 0.84999999999999998 110.917 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.598 HD12 ' HE1' ' A' ' 37' ' ' PHE . 3.8 mm? -55.94 -35.57 66.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.623 0.249 . . . . 0.97999999999999998 110.837 175.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 64.2 tttm -70.27 -27.49 64.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.396 -0.365 . . . . 2.4100000000000001 111.243 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.26 -28.52 14.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.629 0.252 . . . . 1.96 111.676 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 39' ' ' ALA . 74.6 t -83.94 -28.12 7.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.153 0.501 . . . . 0.97999999999999998 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.598 ' HE1' HD12 ' A' ' 33' ' ' LEU . 15.0 m-85 -74.39 -24.94 59.2 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 113.895 1.072 . . . . 0.82999999999999996 113.895 165.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 71.7 mmtt -75.73 -17.81 59.79 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 106.815 -1.55 . . . . 2.1800000000000002 106.815 165.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 36' ' ' VAL . . . 70.16 -79.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 116.94 2.2 . . . . 1.5600000000000001 116.94 154.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.79 -72.34 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 118.628 -1.749 . . . . 1.54 114.09 -157.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -88.36 172.28 30.9 Favored 'Cis proline' 0 N--CA 1.461 -0.438 0 N-CA-C 115.081 1.147 . . . . 1.6799999999999999 115.081 7.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.546 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 15.4 m-85 -100.63 155.79 17.68 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.263 -1.335 . . . . 1.28 110.572 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -101.4 -12.01 18.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.72 -0.673 . . . . 3.5099999999999998 110.707 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -157.66 161.84 38.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.598 -0.274 . . . . 1.52 111.365 -177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.9 m -60.03 -35.16 74.5 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 123.223 0.327 . . . . 1.1799999999999999 111.287 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -49.56 -38.63 31.91 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.998 -0.547 . . . . 2.2400000000000002 112.135 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.546 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.3 mt-10 -70.25 -31.13 68.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.724 -0.217 . . . . 2.2599999999999998 111.434 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 t -72.72 -43.08 63.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.56 -0.534 . . . . 1.1899999999999999 109.56 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.39 -43.21 97.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.55000000000000004 109.785 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.9 -48.23 78.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.413 -0.812 . . . . 0.56999999999999995 111.139 173.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.92 86.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.448 0.642 . . . . 0.5 110.463 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 63' ' ' VAL . 30.0 mt -68.76 -40.17 79.89 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.957 -1.02 . . . . 0.45000000000000001 111.215 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -66.32 -22.22 66.27 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.562 -0.455 . . . . 1.22 111.218 177.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -84.4 -33.05 23.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 3.0499999999999998 110.758 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.77 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 22.8 tptp -90.57 -60.77 1.83 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.886 -0.597 . . . . 1.48 110.769 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.5 p -127.96 85.88 59.54 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 115.87 -0.604 . . . . 1.1599999999999999 109.713 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.32 -60.02 0.93 Allowed 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 124.051 3.167 . . . . 0.57999999999999996 113.747 -168.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.33 -26.06 68.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.649 -1.16 . . . . 2.4500000000000002 111.608 -176.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 52.7 tp -75.19 -39.48 60.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.655 0.741 . . . . 1.4199999999999999 109.546 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.18 -32.09 81.31 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.91 -1.041 . . . . 0.37 111.3 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -34.84 78.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.705 -0.247 . . . . 0.47999999999999998 110.606 174.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 57.8 mttp -61.53 -45.08 95.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.086 0.47 . . . . 2.1699999999999999 110.072 175.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.65 HG21 HD13 ' A' ' 52' ' ' LEU . 21.2 t -71.39 -38.51 69.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.859 -0.61 . . . . 1.1200000000000001 110.763 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.06 -44.01 90.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.486 . . . . 1.7 111.231 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -66.01 -40.55 91.21 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.079 -0.711 . . . . 3.96 109.079 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 21' ' ' PHE . 61.5 tp -65.25 -35.25 80.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.284 -0.871 . . . . 1.5 110.722 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -73.64 -39.63 64.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.46 -0.941 . . . . 2.3399999999999999 108.46 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.63 87.14 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.892 -1.049 . . . . 0.40000000000000002 110.624 176.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.414 ' SD ' ' HA ' ' A' ' 66' ' ' LEU . 21.5 mtp -61.64 -57.61 11.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.306 0.574 . . . . 0.71999999999999997 110.71 176.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 66' ' ' LEU . 87.4 t -58.69 -43.7 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 115.515 -0.766 . . . . 0.79000000000000004 110.708 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -64.51 -34.29 77.87 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.931 -0.577 . . . . 1.47 111.563 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 38.2 t -57.98 -48.9 78.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.084 0.469 . . . . 1.26 110.287 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.515 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 62.2 mttm -66.16 -47.73 73.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.559 -0.746 . . . . 1.54 110.529 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.64 -24.51 33.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.244 0.545 . . . . 0.34000000000000002 111.408 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.92 64.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.468 0.652 . . . . 0.34999999999999998 110.495 174.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.39 -2.54 58.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.191 -0.913 . . . . 0.48999999999999999 110.456 -178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.423 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.4 tp -95.45 130.51 42.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.686 -0.688 . . . . 0.70999999999999996 110.041 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.77 152.26 46.02 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.837 -0.696 . . . . 0.76000000000000001 112.11 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -40.21 -43.28 3.79 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 124.243 3.295 . . . . 1.5600000000000001 114.397 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -63.9 -44.63 92.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.886 0.374 . . . . 2.52 111.159 -176.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -86.07 -30.82 22.32 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.498 -0.481 . . . . 0.35999999999999999 110.411 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -57.89 -46.34 85.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.485 -0.779 . . . . 2.04 110.758 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.28 -41.06 94.78 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.885 -0.674 . . . . 0.40999999999999998 112.067 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.8 t80 -69.52 -46.38 66.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.981 -0.11 . . . . 1.6499999999999999 110.967 176.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.93 -47.16 78.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.118 0.485 . . . . 0.40999999999999998 111.267 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.3 mt-10 -65.73 -39.66 91.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.795 -0.638 . . . . 1.96 110.704 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -74.3 -42.11 60.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.516 -0.311 . . . . 2.1200000000000001 111.487 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.1 p -64.37 -39.36 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.912 0.387 . . . . 0.56999999999999995 110.168 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.33 -39.92 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.773 -0.649 . . . . 1.0900000000000001 110.215 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.629 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.5 mt-10 -66.48 -45.69 78.82 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 111.465 0.172 . . . . 2.8199999999999998 111.465 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.436 HG22 ' OG ' ' A' ' 113' ' ' SER . 68.9 mt -61.97 -43.15 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.959 0.409 . . . . 0.51000000000000001 110.546 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.04 -37.94 75.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.237 -0.438 . . . . 0.64000000000000001 110.015 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -60.05 -43.01 95.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 4.4199999999999999 110.964 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -63.74 -30.15 76.82 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 121.088 -0.577 . . . . 0.66000000000000003 112.496 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -68.0 -46.13 82.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.772 0.32 . . . . 0.55000000000000004 111.35 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -82.4 -17.78 44.25 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.576 -0.449 . . . . 2.7000000000000002 110.199 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.453 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . . . -61.86 -37.9 86.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.805 0.336 . . . . 0.63 110.446 171.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 11.7 ptm180 -89.92 7.81 35.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.086 -0.506 . . . . 3.1000000000000001 110.564 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.38 -41.15 9.15 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.65 -0.871 . . . . 0.96999999999999997 108.65 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.499 ' CE1' HD21 ' A' ' 22' ' ' LEU . 28.5 m-85 -61.98 -34.72 76.67 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.675 -0.693 . . . . 1.48 111.342 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.3 p -73.56 1.62 9.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.209 -0.45 . . . . 0.87 112.179 -178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.432 ' HA3' ' HE2' ' A' ' 34' ' ' LYS . . . 89.16 6.41 71.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.093 -0.575 . . . . 1.1599999999999999 112.356 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 80.4 m-20 -96.47 -176.8 3.74 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.049 -0.352 . . . . 1.8300000000000001 110.049 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.7 mt-10 -147.3 109.3 3.92 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.606 -0.27 . . . . 1.75 110.997 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 26.2 Cg_endo -64.14 157.31 54.28 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.823 2.349 . . . . 0.53000000000000003 112.162 174.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 74.4 p -81.31 171.4 14.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.753 -0.462 . . . . 1.48 109.753 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.96 -26.37 68.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.26 -0.644 . . . . 2.8799999999999999 109.26 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -67.78 -39.16 84.12 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.266 -0.879 . . . . 2.2400000000000002 110.611 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -59.39 -41.65 89.86 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.177 0.513 . . . . 1.73 110.448 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.443 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.8 mp -68.96 -45.03 71.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.81999999999999995 110.669 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 28.8 mtpp -57.63 -48.25 79.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.216 -0.447 . . . . 1.74 110.56 177.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.46999999999999997 110.989 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.508 ' O ' HG13 ' A' ' 117' ' ' VAL . 27.1 t -54.46 -49.63 69.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 1.3400000000000001 111.095 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.633 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.1 m -81.44 -22.58 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.765 0.793 . . . . 0.65000000000000002 109.951 -174.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 46.8 tttm -67.98 -45.68 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.784 -1.098 . . . . 1.72 111.138 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 15.1 mm-40 -70.69 -34.05 71.56 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.623 -0.431 . . . . 2.27 110.656 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.0 -31.89 55.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.616 -0.433 . . . . 0.81000000000000005 110.391 176.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -73.05 -36.27 66.86 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.051 -0.352 . . . . 1.21 110.051 175.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.422 ' HD2' HD12 ' A' ' 120' ' ' LEU . 2.2 ttmm -59.5 -48.02 83.26 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.026 -0.731 . . . . 0.94999999999999996 109.026 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -68.54 -45.51 71.96 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.876 -1.056 . . . . 1.0600000000000001 111.768 176.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 10.4 t80 -69.52 -37.04 76.96 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.274 -0.571 . . . . 1.54 111.643 -170.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -65.16 -27.78 68.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 1.98 111.395 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.41 -6.86 59.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.089 -0.505 . . . . 0.69999999999999996 112.055 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.6 mtm -76.4 153.95 35.27 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.5 110.382 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -65.8 150.25 48.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.64 -0.255 . . . . 1.1799999999999999 110.559 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -54.93 -46.56 74.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.217 0.451 . . . . 2.21 112.217 -171.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.31 -32.97 70.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.41999999999999998 110.926 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.14 -34.16 55.73 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.881 -0.6 . . . . 0.31 111.788 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -64.54 -45.88 85.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.076 0.465 . . . . 1.3200000000000001 110.359 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.59 -28.19 65.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.41999999999999998 110.86 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 15.8 t70 -77.31 -35.34 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.505 -0.554 . . . . 0.55000000000000004 109.505 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -60.57 -31.02 70.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.745 -0.661 . . . . 0.39000000000000001 110.297 172.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.76 -5.63 69.77 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.098 -0.572 . . . . 0.27000000000000002 113.248 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 77.6 mttt -94.74 -42.06 8.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.783 0.802 . . . . 2.4300000000000002 109.485 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.515 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.9 mp0 -80.96 -40.28 24.72 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.769 -1.105 . . . . 1.8300000000000001 110.968 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -130.87 72.88 81.63 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.052 0.453 . . . . 0.68999999999999995 110.713 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -65.47 -32.48 49.38 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.957 2.438 . . . . 0.63 112.964 -176.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.48 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 44.2 t80 -60.45 -41.77 94.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.916 0.389 . . . . 2.3100000000000001 110.554 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.41 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.1 mt -77.62 -42.84 33.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.245 -0.434 . . . . 1.02 110.533 -178.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.16 -34.58 72.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.058 0.456 . . . . 0.34999999999999998 110.215 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.7 tttp -52.91 -70.85 0.08 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.223 -0.899 . . . . 2.5800000000000001 111.477 171.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 3.4 m -62.5 -30.41 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.165 -0.925 . . . . 0.5 112.955 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.41 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.6 m-30 -67.1 -47.89 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.134 -0.626 . . . . 0.62 110.216 -179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -72.19 -38.59 69.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 2.5800000000000001 111.353 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 31.2 t -70.77 -20.68 62.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 1.3200000000000001 110.705 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 96.66 2.14 60.02 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.751 -0.738 . . . . 1.0900000000000001 112.372 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.604 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 44.3 tptt -56.98 -46.72 82.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.829 0.347 . . . . 1.98 110.853 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -77.89 -36.94 49.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.141 0.496 . . . . 0.34000000000000002 110.34 177.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.44 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -57.69 -46.95 83.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.533 -0.758 . . . . 0.51000000000000001 111.758 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -65.47 -35.49 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 2.8199999999999998 110.851 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -64.07 -35.37 80.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.304 0.573 . . . . 0.48999999999999999 109.872 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.598 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -78.69 -22.88 46.03 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.662 -0.699 . . . . 0.58999999999999997 111.683 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.467 0 N-CA-C 111.277 -0.729 . . . . 1.6200000000000001 111.277 -174.79 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.8 p90 . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.11 0.481 . . . . 1.47 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' ILE . 33.6 mmtp -120.44 139.33 52.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.177 -0.465 . . . . 3.1499999999999999 109.922 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.53 -30.32 71.06 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.409 -0.589 . . . . 2.3500000000000001 109.409 175.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -74.9 -19.35 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 4.1600000000000001 110.698 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -89.96 -13.13 36.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.166 0.508 . . . . 2.5699999999999998 110.0 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 2' ' ' LYS . 70.8 mt -77.52 129.78 76.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 109.079 -0.712 . . . . 0.68999999999999995 109.079 175.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.84 113.66 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.336 2.691 . . . . 0.59999999999999998 112.379 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.36 65.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.711 -0.677 . . . . 0.56999999999999995 111.686 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.87 -35.57 76.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.745 0.783 . . . . 1.3700000000000001 110.263 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -85.56 -29.77 23.88 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 114.585 -1.189 . . . . 0.80000000000000004 111.064 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -68.45 -27.05 65.84 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.196 -0.668 . . . . 1.73 109.196 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.61 -32.27 71.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.312 -1.313 . . . . 1.02 110.615 174.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -80.57 -31.08 36.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.543 -0.753 . . . . 0.93000000000000005 111.194 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 73.7 mtm -71.21 134.83 84.89 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 1.1499999999999999 111.33 -176.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.4 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 44.1 Cg_endo -68.92 146.02 63.99 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.721 2.281 . . . . 0.90000000000000002 112.265 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -43.74 -49.35 8.11 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 123.721 2.947 . . . . 0.95999999999999996 113.813 -173.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.536 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.8 pm0 -57.56 -39.41 76.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.798 0.332 . . . . 1.8300000000000001 111.811 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -14.51 60.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.774 0.321 . . . . 0.81999999999999995 111.072 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 19' ' ' ARG . 16.8 mtm180 -91.39 -33.71 15.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 2.1600000000000001 110.299 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.05 -45.45 32.26 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.579 . . . . 1.0600000000000001 111.45 178.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.446 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 38.5 t80 -70.81 1.19 5.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.833 -0.621 . . . . 0.65000000000000002 112.334 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.535 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.9 mt -127.83 -16.27 4.72 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.569 -0.707 . . . . 1.1299999999999999 111.27 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.51 -41.25 98.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.886 -0.783 . . . . 2.0600000000000001 108.886 164.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -75.58 -51.78 12.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.142 -0.936 . . . . 1.8400000000000001 112.709 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.535 HD13 HD11 ' A' ' 33' ' ' LEU . 42.0 mt -58.14 142.04 48.43 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.951 0.882 . . . . 1.05 112.79 -172.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.0 p -136.35 -164.55 1.58 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 113.957 -1.474 . . . . 1.78 109.804 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.72 151.52 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.703 0.287 . . . . 2.3900000000000001 110.432 177.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . 86.9 -45.56 3.45 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.666 -0.778 . . . . 0.93000000000000005 112.374 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.618 ' O ' HG12 ' A' ' 32' ' ' VAL . 6.4 m-20 -74.67 -37.05 62.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.542 0.687 . . . . 2.25 109.733 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HA ' HD12 ' A' ' 33' ' ' LEU . 89.0 mttt -70.33 -18.02 63.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.633 -0.712 . . . . 1.3100000000000001 110.194 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 53.1 m -66.89 -40.85 87.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.098 -0.955 . . . . 0.80000000000000004 111.003 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.3 p -79.23 -27.06 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 0.84999999999999998 110.631 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 25' ' ' LEU . 87.8 mt -56.92 -49.84 74.39 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 111.8 0.296 . . . . 0.97999999999999998 111.8 177.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.0 pttm -61.09 -25.26 66.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.822 0.344 . . . . 2.4100000000000001 110.884 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.78 -35.97 75.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.02 0.438 . . . . 1.96 110.438 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.2 t -73.81 -55.89 10.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.575 0.702 . . . . 0.97999999999999998 110.137 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HD2' ' O ' ' A' ' 33' ' ' LEU . 72.9 m-85 -58.27 -46.56 85.81 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 114.763 1.394 . . . . 0.82999999999999996 114.763 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -77.98 -13.55 59.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 118.501 0.591 . . . . 2.1800000000000002 111.326 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -79.8 -78.33 0.16 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.325 -0.398 . . . . 1.5600000000000001 109.997 170.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 45.94 -157.56 0.37 Allowed Glycine 0 CA--C 1.523 0.54 0 C-N-CA 121.01 -0.614 . . . . 1.54 113.394 -174.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.4 Cg_endo -91.47 172.69 21.91 Favored 'Cis proline' 0 N--CA 1.457 -0.663 0 C-N-CA 124.231 -1.154 . . . . 1.6799999999999999 111.196 -7.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.49 106.53 8.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.272 0.558 . . . . 1.28 111.671 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -72.71 -18.92 61.49 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.205 -0.907 . . . . 3.5099999999999998 110.026 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -145.5 157.92 43.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 1.52 109.61 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.5 m -76.13 -27.42 57.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.953 -0.567 . . . . 1.1799999999999999 111.518 -174.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -58.57 -42.99 89.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.728 0.299 . . . . 2.2400000000000002 110.842 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.24 -33.81 72.82 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.34 0.59 . . . . 2.2599999999999998 110.896 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.8 t -74.04 -42.55 60.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 1.1899999999999999 110.364 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 78.4 mt -64.32 -42.53 95.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.326 0.584 . . . . 0.55000000000000004 109.886 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.34 -38.05 76.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.137 -0.938 . . . . 0.56999999999999995 111.381 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.65 -38.08 80.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.412 0.625 . . . . 0.5 110.349 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.81 -35.55 67.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.289 -0.869 . . . . 0.45000000000000001 111.17 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -63.37 -41.81 98.82 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 121.071 -0.252 . . . . 1.22 111.656 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.71 -33.57 66.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.929 0.395 . . . . 3.0499999999999998 110.791 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.436 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 29.7 mmtm -77.82 -47.67 18.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.158 -0.474 . . . . 1.48 111.716 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -148.62 95.51 3.98 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-O 120.688 0.28 . . . . 1.1599999999999999 110.67 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -41.07 -56.53 1.67 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 124.122 3.215 . . . . 0.57999999999999996 113.827 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.02 -33.26 75.04 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 115.193 -0.912 . . . . 2.4500000000000002 112.435 -178.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -72.25 -42.36 65.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.8 -0.815 . . . . 1.4199999999999999 108.8 -176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.421 ' HA2' HG22 ' A' ' 63' ' ' VAL . . . -64.91 -33.99 88.7 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.051 -1.431 . . . . 0.37 111.449 174.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.1 72.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.763 0.316 . . . . 0.47999999999999998 110.895 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 26.7 mtpp -67.03 -54.92 17.05 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.595 -0.275 . . . . 2.1699999999999999 110.337 175.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.421 HG22 ' HA2' ' A' ' 60' ' ' GLY . 25.6 m -67.61 -22.61 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.166 0 C-N-CA 120.906 -0.318 . . . . 1.1200000000000001 111.188 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.75 -58.26 9.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.064 -0.516 . . . . 1.7 109.838 172.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -71.95 -32.58 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.798 -0.637 . . . . 3.96 109.969 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -62.61 -41.6 99.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 1.5 109.452 179.316 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -74.3 -38.76 63.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.913 -0.773 . . . . 2.3399999999999999 108.913 -176.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.33 95.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.821 -1.081 . . . . 0.40000000000000002 111.014 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 28.9 mtp -55.88 -55.01 37.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.097 0.475 . . . . 0.71999999999999997 110.8 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.453 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 69.3 t -58.58 -44.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-N 115.149 -0.932 . . . . 0.79000000000000004 110.554 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -60.54 -37.51 81.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.671 -0.695 . . . . 1.47 111.512 177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.8 m -64.09 -37.78 88.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 1.26 110.859 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 95.8 mttt -72.44 -23.68 61.1 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.435 -0.348 . . . . 1.54 110.576 177.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.45 HG23 ' HB2' ' A' ' 82' ' ' LYS . 67.3 mt -89.15 -19.14 7.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.769 0.795 . . . . 0.34000000000000002 110.159 175.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.03 -36.77 58.95 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.211 -0.904 . . . . 0.34999999999999998 109.789 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.509 ' HB3' ' OE1' ' A' ' 135' ' ' GLN . . . -90.55 -8.01 51.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.722 -1.126 . . . . 0.48999999999999999 109.448 -178.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.8 tp -86.9 121.9 30.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 106.377 -1.712 . . . . 0.70999999999999996 106.377 172.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.803 ' N ' ' HD3' ' A' ' 79' ' ' PRO . . . -99.21 -12.36 42.53 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.528 1.371 . . . . 0.76000000000000001 116.528 -172.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.803 ' HD3' ' N ' ' A' ' 78' ' ' GLY . 8.6 Cg_endo -98.97 -146.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.089 0 CA-C-N 121.501 2.651 . . . . 1.5600000000000001 116.844 -170.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -80.01 -7.07 58.63 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 106.613 -1.625 . . . . 2.52 106.613 167.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -68.88 -36.49 78.14 Favored 'General case' 0 CA--C 1.499 -0.982 0 CA-C-N 115.361 -0.836 . . . . 0.35999999999999999 109.467 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.626 ' HD2' ' O ' ' A' ' 77' ' ' LEU . 1.0 OUTLIER -72.42 -36.75 68.69 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.635 -0.711 . . . . 2.04 109.098 177.031 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.408 ' N ' ' HG2' ' A' ' 82' ' ' LYS . . . -64.36 -43.44 96.83 Favored Glycine 0 C--N 1.336 0.542 0 C-N-CA 120.091 -1.052 . . . . 0.40999999999999998 111.623 174.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 8.8 t80 -66.06 -39.05 89.78 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.708 0.403 . . . . 1.6499999999999999 111.063 176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.55 -43.03 79.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.483 0.658 . . . . 0.40999999999999998 110.356 177.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 7.4 mm-40 -59.46 -30.88 68.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.008 -0.996 . . . . 1.96 111.108 177.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -87.37 -47.01 9.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.435 -0.348 . . . . 2.1200000000000001 111.032 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.428 ' HB3' ' CE1' ' A' ' 84' ' ' PHE . 10.1 p -61.11 -47.08 87.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.198 -0.455 . . . . 0.56999999999999995 111.472 -175.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.0 -40.11 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 1.0900000000000001 110.279 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -62.8 -45.01 94.63 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.372 -0.377 . . . . 2.8199999999999998 111.178 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -65.01 -46.56 91.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.579 -0.282 . . . . 0.51000000000000001 110.932 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.73 88.46 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.299 0.571 . . . . 0.64000000000000001 110.007 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt85 -59.38 -35.84 74.67 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.346 -0.843 . . . . 4.4199999999999999 110.78 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.03 -35.34 90.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.018 -0.61 . . . . 0.66000000000000003 112.474 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.613 HG21 HD23 ' A' ' 110' ' ' LEU . 49.1 mm -71.69 -48.22 53.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.095 0.474 . . . . 0.55000000000000004 109.921 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -85.23 27.53 0.79 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.668 0.747 . . . . 2.7000000000000002 110.258 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -117.06 -27.65 6.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.63 109.599 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.434 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 17.8 ptp180 -91.47 -1.03 57.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.116 -0.493 . . . . 3.1000000000000001 109.997 176.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -83.65 -38.59 21.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.999 -0.741 . . . . 0.96999999999999997 108.999 163.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.535 ' CE1' HD21 ' A' ' 22' ' ' LEU . 4.4 m-30 -67.86 -24.96 65.31 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.349 -0.841 . . . . 1.48 111.41 -173.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -77.65 -4.58 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.853 -0.612 . . . . 0.87 112.177 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.79 7.83 65.97 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.415 -0.897 . . . . 1.1599999999999999 111.346 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -100.55 166.0 11.14 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.865 -0.791 . . . . 1.8300000000000001 108.865 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 50.2 mt-10 -134.92 110.22 10.93 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 121.028 -0.269 . . . . 1.75 111.297 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 14.6 Cg_endo -61.55 151.55 79.24 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.416 2.078 . . . . 0.53000000000000003 111.348 173.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.7 p -81.17 167.57 19.5 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.576 -0.527 . . . . 1.48 109.576 177.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.494 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 39.4 ttpt -64.24 -29.64 70.73 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.249 -0.649 . . . . 2.8799999999999999 109.249 177.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -65.34 -36.28 83.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.241 -0.891 . . . . 2.2400000000000002 110.896 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -60.69 -44.32 96.66 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.121 0.486 . . . . 1.73 109.985 173.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.613 HD23 HG21 ' A' ' 95' ' ' ILE . 61.7 mt -66.32 -40.31 89.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.298 -0.864 . . . . 0.81999999999999995 111.411 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 94.5 mttt -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.091 0.472 . . . . 1.74 110.238 176.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.549 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -62.51 -43.98 97.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.765 -0.652 . . . . 0.46999999999999997 111.541 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.445 ' O ' HG13 ' A' ' 117' ' ' VAL . 5.2 p -61.77 -32.25 72.51 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.38 0.511 . . . . 1.3400000000000001 112.38 -177.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.9 m -87.63 -25.74 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-O 121.511 0.672 . . . . 0.65000000000000002 110.126 -178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.9 ptmm? -79.61 -24.62 41.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.509 -0.769 . . . . 1.72 110.937 -175.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 20.1 mm-40 -78.76 -38.95 37.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.341 -0.543 . . . . 2.27 110.438 175.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.5 m -66.36 -29.43 46.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.611 -0.435 . . . . 0.81000000000000005 110.017 176.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.91 -40.83 78.89 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.086 -0.709 . . . . 1.21 109.086 172.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 5.4 tmmm? -54.02 -46.56 71.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.731 -0.668 . . . . 0.94999999999999996 110.289 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.32 -46.82 81.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.384 -0.371 . . . . 1.0600000000000001 111.342 171.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 48.3 t80 -72.54 -33.52 66.91 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 119.739 -0.784 . . . . 1.54 112.41 -167.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -63.77 -32.34 73.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 1.98 110.573 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.95 -4.34 59.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.232 0.827 . . . . 0.69999999999999996 113.232 -171.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 37.4 mtm -75.53 155.68 35.85 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.093 -0.643 . . . . 0.5 110.712 -178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.6 m -60.79 146.65 45.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.52 -0.309 . . . . 1.1799999999999999 110.208 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.19 -47.56 75.08 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.25 0.463 . . . . 2.21 112.25 -170.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.94 -33.14 68.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.41999999999999998 110.882 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -72.41 -38.33 58.23 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.477 -0.783 . . . . 0.31 111.651 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.32 -45.95 82.23 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.705 -0.48 . . . . 1.3200000000000001 109.705 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.75 90.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.605 -0.725 . . . . 0.41999999999999998 111.461 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.8 -29.92 70.9 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.018 0.437 . . . . 0.55000000000000004 110.386 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -58.8 -27.97 65.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.718 -0.673 . . . . 0.39000000000000001 110.514 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.421 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -68.56 -23.59 75.31 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.243 -0.503 . . . . 0.27000000000000002 113.145 -178.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.19 21.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.938 0.399 . . . . 2.4300000000000002 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.509 ' OE1' ' HB3' ' A' ' 76' ' ' ALA . 32.9 mm-40 -82.55 -46.39 13.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.713 -0.676 . . . . 1.8300000000000001 112.057 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.453 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 39.0 m-85 -122.08 73.33 36.67 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 121.144 0.497 . . . . 0.68999999999999995 110.107 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' PRO . . . . . 0.414 ' O ' ' HB2' ' A' ' 141' ' ' LYS . 54.9 Cg_endo -68.69 -25.79 33.66 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.994 2.463 . . . . 0.63 112.895 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' HG13 ' A' ' 142' ' ' VAL . 3.6 m-85 -68.72 -50.6 49.44 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.546 -0.297 . . . . 2.3100000000000001 111.166 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.49 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -66.39 -44.35 83.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.676 -0.49 . . . . 1.02 109.676 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.421 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -55.34 -46.54 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.016 0.436 . . . . 0.34999999999999998 110.612 177.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 137' ' ' PRO . 0.8 OUTLIER -47.59 -67.43 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.252 -0.886 . . . . 2.5800000000000001 111.447 174.704 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.7 m -63.93 -23.07 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.014 -0.994 . . . . 0.5 112.798 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.49 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 22.2 m-30 -77.59 -44.54 28.06 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.316 -0.553 . . . . 0.62 110.746 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.07 -35.27 71.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.13 0.49 . . . . 2.5800000000000001 110.13 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.1 m -82.6 167.57 18.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.37 -0.832 . . . . 1.3200000000000001 110.307 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -78.79 55.25 4.2 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.895 -0.669 . . . . 1.0900000000000001 111.502 176.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.502 ' HG2' ' HB ' ' A' ' 142' ' ' VAL . 15.7 tppt? -108.84 -76.3 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.228 -0.286 . . . . 1.98 110.228 -179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.2 80.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.34000000000000002 110.55 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.33 68.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.51000000000000001 111.471 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -85.44 -38.07 19.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.187 -0.46 . . . . 2.8199999999999998 111.111 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -58.34 -39.98 80.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.157 0.503 . . . . 0.48999999999999999 109.783 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.526 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -65.64 -31.52 72.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.444 -0.798 . . . . 0.58999999999999997 111.093 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.454 0 C-N-CA 120.938 -0.649 . . . . 1.6200000000000001 111.673 -177.706 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.6 p90 . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.037 0.446 . . . . 1.47 111.045 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.402 ' H ' ' HB3' ' A' ' 5' ' ' ASP . 68.6 mttm -113.83 165.68 12.33 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.887 -0.597 . . . . 3.1499999999999999 109.68 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -55.33 -51.11 67.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 2.3500000000000001 110.254 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -77.75 10.32 2.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.868 -0.605 . . . . 4.1600000000000001 112.463 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 2' ' ' LYS . 30.6 t70 -102.04 -19.57 15.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.127 0.489 . . . . 2.5699999999999998 110.633 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.45 ' HB ' ' HD3' ' A' ' 11' ' ' ARG . 50.9 mt -74.02 138.93 76.01 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.012 -0.736 . . . . 0.68999999999999995 109.012 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.49 ' HG2' HD22 ' A' ' 110' ' ' LEU . 25.2 Cg_exo -37.69 110.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.492 2.795 . . . . 0.59999999999999998 112.603 175.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' ASP . . . -70.06 -17.39 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.681 -0.691 . . . . 0.56999999999999995 111.923 -171.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -69.55 -32.3 71.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.923 0.868 . . . . 1.3700000000000001 108.911 176.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.444 ' CG ' HD23 ' A' ' 110' ' ' LEU . 81.1 t80 -82.57 -38.11 24.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.044 -1.435 . . . . 0.80000000000000004 110.816 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' HD3' ' HB ' ' A' ' 6' ' ' ILE . 50.6 mtm180 -67.18 -27.99 67.73 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.737 0.78 . . . . 1.73 109.622 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 1.0 OUTLIER -69.93 -10.59 59.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.289 -1.323 . . . . 1.02 111.068 176.038 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.9 mt -97.95 -16.4 19.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.355 . . . . 0.93000000000000005 110.311 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.3 mtm -82.24 135.13 47.77 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.316 -0.402 . . . . 1.1499999999999999 111.209 -174.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.435 ' HD3' HD21 ' A' ' 139' ' ' LEU . 72.1 Cg_endo -75.48 160.62 38.38 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.881 2.387 . . . . 0.90000000000000002 112.489 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -43.65 -49.1 8.2 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 123.255 2.637 . . . . 0.95999999999999996 112.913 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.18 -60.03 2.76 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.087 0.47 . . . . 1.8300000000000001 111.412 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 -8.46 54.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.81999999999999995 112.007 -173.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -96.84 -34.66 11.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.502 -0.317 . . . . 2.1600000000000001 110.749 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -52.05 -47.65 64.99 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.361 0.413 . . . . 1.0600000000000001 111.645 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.485 ' O ' HD23 ' A' ' 25' ' ' LEU . 33.7 t80 -60.56 -60.24 4.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.172 -0.467 . . . . 0.65000000000000002 111.571 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.488 HD21 ' CE1' ' A' ' 100' ' ' TYR . 34.6 mt -75.82 -4.65 41.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.274 0.943 . . . . 1.1299999999999999 112.336 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -68.41 -36.19 78.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.498 -0.556 . . . . 2.0600000000000001 109.498 163.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -78.02 -50.08 12.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.267 -0.879 . . . . 1.8400000000000001 112.253 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.4 mm? -55.25 138.04 46.01 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.259 0.552 . . . . 1.05 110.786 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.3 m -121.58 -67.61 0.95 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 1.78 111.278 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -164.07 -52.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.74 0.274 . . . . 2.3900000000000001 111.74 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -70.03 -30.8 69.69 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.829 -0.7 . . . . 0.93000000000000005 111.552 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.708 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.5 p30 -72.53 -41.65 65.6 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.179 -0.511 . . . . 2.25 110.526 175.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.26 -20.68 63.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.13 0.49 . . . . 1.3100000000000001 110.776 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 58.2 m -67.8 -30.07 69.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.631 -0.713 . . . . 0.80000000000000004 110.936 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.708 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -90.81 -30.12 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-N 116.29 -0.414 . . . . 0.84999999999999998 110.773 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.615 ' O ' HG22 ' A' ' 36' ' ' VAL . 4.4 mm? -53.92 -45.85 71.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.351 0.12 . . . . 0.97999999999999998 110.967 173.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 17.8 pttp -59.9 -27.08 66.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.591 -0.444 . . . . 2.4100000000000001 110.959 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -78.18 -39.02 42.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.8 0.333 . . . . 1.96 110.439 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 32' ' ' VAL . 2.3 m -69.83 -37.41 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.97999999999999998 110.219 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 24.9 m-85 -67.49 -38.22 84.03 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.238 1.199 . . . . 0.82999999999999996 114.238 173.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -85.25 16.87 3.33 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.627 -0.829 . . . . 2.1800000000000002 110.291 -178.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.93 11.57 17.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 1.5600000000000001 109.541 174.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.69 -159.97 32.72 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.521 -0.763 . . . . 1.54 111.849 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.55 160.0 93.89 Favored 'Cis proline' 0 C--O 1.233 0.274 0 C-N-CA 123.675 -1.386 . . . . 1.6799999999999999 112.839 1.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.551 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 60.0 m-85 -116.6 140.92 48.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.629 -0.714 . . . . 1.28 110.106 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.3 -12.97 60.16 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.634 -0.712 . . . . 3.5099999999999998 110.289 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -158.06 165.58 34.68 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.116 -0.493 . . . . 1.52 110.286 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -65.89 -30.15 70.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.118 0.485 . . . . 1.1799999999999999 110.588 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -54.08 -42.82 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.435 -0.802 . . . . 2.2400000000000002 112.087 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.551 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 30.3 mt-10 -63.76 -33.14 74.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.418 -0.355 . . . . 2.2599999999999998 111.131 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.5 t -73.21 -32.23 64.66 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.849 -0.426 . . . . 1.1899999999999999 109.849 177.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.7 -40.84 90.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.406 0.622 . . . . 0.55000000000000004 109.556 175.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.81 -46.18 90.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.035 -0.984 . . . . 0.56999999999999995 110.879 175.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.421 ' CB ' ' HB ' ' A' ' 36' ' ' VAL . . . -56.77 -39.14 73.49 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.053 -0.522 . . . . 0.5 110.973 177.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 33' ' ' LEU . 14.1 mt -71.21 -42.25 69.2 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.45000000000000001 111.448 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -61.14 -34.66 75.35 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.874 0.368 . . . . 1.22 111.429 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -73.95 -38.29 64.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.056 -0.52 . . . . 3.0499999999999998 111.657 -179.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -91.48 -36.89 13.49 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.228 0.455 . . . . 1.48 112.228 -175.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -145.18 88.27 6.83 Favored Pre-proline 0 C--N 1.32 -0.715 0 N-CA-C 109.336 -0.616 . . . . 1.1599999999999999 109.336 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 63.1 Cg_exo -41.18 -54.41 2.59 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 124.102 3.201 . . . . 0.57999999999999996 113.751 -170.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 6.1 mp0 -58.96 -36.0 74.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.945 -1.025 . . . . 2.4500000000000002 112.326 -177.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.55 -36.6 79.01 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 120.011 -0.676 . . . . 1.4199999999999999 109.315 -175.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.13 81.52 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.639 -1.164 . . . . 0.37 111.707 176.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 -38.79 63.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.75 0.31 . . . . 0.47999999999999998 110.547 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.4 mmmt -63.2 -42.12 99.28 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.116 -0.493 . . . . 2.1699999999999999 110.602 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.63 -30.07 16.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.392 -0.367 . . . . 1.1200000000000001 110.718 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.46 -51.86 63.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.549 -0.296 . . . . 1.7 110.628 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 69' ' ' MET . 20.9 pttp -60.11 -35.49 75.34 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.774 0.797 . . . . 3.96 109.573 -177.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.474 ' C ' HD13 ' A' ' 66' ' ' LEU . 1.5 tm? -65.04 -48.5 73.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.387 -1.279 . . . . 1.5 110.303 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.581 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 84.2 t60 -77.98 -32.12 51.09 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.52 -0.548 . . . . 2.3399999999999999 109.52 -170.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.37 93.6 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.379 -0.828 . . . . 0.40000000000000002 111.528 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 60.7 mtm -56.32 -52.15 65.59 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.649 0.738 . . . . 0.71999999999999997 109.367 174.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 66' ' ' LEU . 52.9 t -51.66 -49.47 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 114.107 -1.406 . . . . 0.79000000000000004 110.917 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.1 mmmt -63.2 -40.63 98.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.749 . . . . 1.47 111.928 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.9 t -60.56 -40.05 90.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.022 0.439 . . . . 1.26 110.666 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 95.2 mttt -74.0 -41.71 61.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.836 -0.62 . . . . 1.54 110.788 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -69.93 -26.24 29.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.196 0.522 . . . . 0.34000000000000002 110.807 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.6 81.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.579 0.704 . . . . 0.34999999999999998 109.924 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.07 -2.29 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.743 -1.117 . . . . 0.48999999999999999 110.743 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.471 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 11.7 tp -95.05 133.28 39.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.823 -0.626 . . . . 0.70999999999999996 109.731 -176.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.41 151.2 50.54 Favored Glycine 0 C--O 1.226 -0.394 0 C-N-CA 120.8 -0.714 . . . . 0.76000000000000001 112.0 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -39.17 -40.4 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.391 3.394 . . . . 1.5600000000000001 114.495 -176.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -70.02 -46.24 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.263 -0.175 . . . . 2.52 111.236 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.471 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -80.29 -33.17 37.91 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.606 0.717 . . . . 0.35999999999999999 109.974 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -58.03 -44.4 87.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.676 -1.147 . . . . 2.04 111.304 177.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.23 -38.83 96.29 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 0.40999999999999998 111.927 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 15.4 t80 -68.47 -44.05 75.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.526 0.203 . . . . 1.6499999999999999 110.998 176.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.22 85.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.034 0.445 . . . . 0.40999999999999998 111.024 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -62.46 -39.71 94.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.83 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -71.06 -51.28 26.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 2.1200000000000001 111.529 -177.263 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.3 p -59.15 -39.91 83.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.952 0.406 . . . . 0.56999999999999995 110.997 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.7 mt -70.34 -41.03 78.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 116.091 -0.504 . . . . 1.0900000000000001 111.603 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 14.8 pt-20 -69.68 -28.01 65.49 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.454 -0.498 . . . . 2.8199999999999998 110.668 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 87' ' ' LYS . 98.2 mt -69.77 -48.96 61.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.014 0.435 . . . . 0.51000000000000001 110.044 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.49 -33.93 76.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.92 -0.582 . . . . 0.64000000000000001 110.734 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -56.96 -39.78 75.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.955 -0.566 . . . . 4.4199999999999999 110.38 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 98' ' ' ARG . . . -66.98 -30.72 76.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.927 -0.654 . . . . 0.66000000000000003 112.015 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -63.53 -53.8 40.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.075 0.464 . . . . 0.55000000000000004 110.542 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -74.48 -15.67 60.88 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.361 -0.382 . . . . 2.7000000000000002 110.863 177.672 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.03 71.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 119.936 -0.706 . . . . 0.63 109.989 170.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.456 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 47.1 mtt180 -88.77 -9.43 51.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.184 -0.462 . . . . 3.1000000000000001 110.186 176.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.442 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 30.6 m-85 -83.25 -43.94 15.51 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.392 -0.596 . . . . 0.96999999999999997 109.392 167.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.521 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 25.8 m-85 -61.08 -36.3 79.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.192 -0.458 . . . . 1.48 111.778 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 1.8 p -74.49 -11.44 60.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.87 112.737 -176.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.14 58.76 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.839 -0.696 . . . . 1.1599999999999999 113.225 -176.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -88.71 -42.89 11.68 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.907 0.354 . . . . 1.8300000000000001 111.236 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 65.41 88.88 0.11 Allowed Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 123.728 0.642 . . . . 1.75 112.321 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.94 144.43 5.96 Favored 'Trans proline' 0 C--O 1.237 0.457 0 C-N-CA 123.62 2.88 . . . . 0.53000000000000003 113.019 172.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.7 t -79.61 166.0 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.047 -0.723 . . . . 1.48 109.047 174.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 22.0 ptmt -58.03 -34.44 70.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.283 0.492 . . . . 2.8799999999999999 110.496 -176.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.99 -25.55 66.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.746 -0.661 . . . . 2.2400000000000002 111.493 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -70.16 -40.59 74.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.347 0.594 . . . . 1.73 109.982 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.9 mp -72.41 -39.68 67.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.81999999999999995 110.716 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.0 mtpm? -58.32 -47.02 85.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.229 0.538 . . . . 1.74 110.021 176.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -64.53 -39.25 93.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.532 -0.758 . . . . 0.46999999999999997 112.301 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.9 p -71.88 -31.9 66.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.396 0.517 . . . . 1.3400000000000001 112.396 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.868 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.9 m -78.41 -24.43 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.458 0.647 . . . . 0.65000000000000002 109.307 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 63.5 mttm -53.26 -48.78 67.99 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.276 -0.874 . . . . 1.72 111.385 174.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' LEU . 6.4 mm-40 -70.27 -33.42 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.391 -0.368 . . . . 2.27 110.922 -171.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.3 m -67.95 -28.03 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 C-N-CA 120.231 -0.588 . . . . 0.81000000000000005 109.95 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.528 HD13 ' HA ' ' A' ' 149' ' ' ALA . 44.3 mt -82.35 -30.31 30.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.81 0.338 . . . . 1.21 110.283 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -61.49 -35.42 77.61 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.607 0.718 . . . . 0.94999999999999996 109.264 177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 124' ' ' MET . 10.8 mp -81.87 -45.7 15.13 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 114.755 -1.111 . . . . 1.0600000000000001 111.369 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 143' ' ' PHE . 47.4 t80 -74.63 -36.32 62.91 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 119.301 -0.96 . . . . 1.54 111.611 -169.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -66.66 -29.49 69.51 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.221 -0.659 . . . . 1.98 109.221 176.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -102.22 72.1 1.28 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.189 -0.914 . . . . 0.69999999999999996 110.809 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.618 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 32.0 mtm -150.02 157.47 43.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.691 -0.686 . . . . 0.5 110.669 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.4 m -62.57 138.35 58.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.228 0.537 . . . . 1.1799999999999999 110.445 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -58.49 -37.88 76.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.128 -0.942 . . . . 2.21 112.533 -172.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.92 -34.83 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 0.41999999999999998 110.834 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.69 -38.69 56.86 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.985 -0.626 . . . . 0.31 111.64 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.79 -45.22 90.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.042 0.448 . . . . 1.3200000000000001 110.608 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.0 71.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.77 -0.65 . . . . 0.41999999999999998 111.782 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -74.23 -30.72 62.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.55000000000000004 109.823 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -60.32 -31.08 69.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.912 -0.586 . . . . 0.39000000000000001 109.928 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.75 -12.03 73.95 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 121.092 -0.575 . . . . 0.27000000000000002 112.849 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -86.51 -33.29 20.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.58 0.705 . . . . 2.4300000000000002 109.781 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.6 mm-40 -92.25 -38.8 11.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.001 -1.0 . . . . 1.8300000000000001 110.934 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -131.26 75.14 78.19 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-O 121.215 0.531 . . . . 0.68999999999999995 110.166 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -66.86 -29.38 41.77 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.433 2.756 . . . . 0.63 113.043 -175.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.583 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 26.0 t80 -74.45 -37.04 63.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.949 0.404 . . . . 2.3100000000000001 109.933 -177.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.435 HD21 ' HD3' ' A' ' 15' ' ' PRO . 79.0 mt -74.9 -46.64 34.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 1.02 110.302 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.95 -39.16 74.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.34999999999999998 109.907 177.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 55.2 tttp -44.4 -68.31 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.131 -0.94 . . . . 2.5800000000000001 111.701 172.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG12 ' HD3' ' A' ' 147' ' ' LYS . 2.2 m -71.9 -16.24 18.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 114.997 -1.001 . . . . 0.5 112.753 -173.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HB3' ' CD2' ' A' ' 121' ' ' TYR . 22.3 m-30 -84.95 -36.41 21.41 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.433 -0.507 . . . . 0.62 110.941 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 48.0 mt-10 -66.42 -52.35 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.081 0.467 . . . . 2.5800000000000001 109.881 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -75.16 159.45 31.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.682 -0.69 . . . . 1.3200000000000001 109.929 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.07 52.41 3.32 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.738 -0.744 . . . . 1.0900000000000001 111.828 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.443 ' HD3' HG12 ' A' ' 142' ' ' VAL . 61.6 tttm -100.06 -64.25 1.06 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.789 0.328 . . . . 1.98 110.155 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.45 -33.76 69.64 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.301 0.572 . . . . 0.34000000000000002 109.544 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.528 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -55.79 -37.91 69.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.098 -0.956 . . . . 0.51000000000000001 111.55 177.732 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -85.81 -20.21 29.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.541 -0.3 . . . . 2.8199999999999998 111.413 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.437 ' HD2' HG21 ' A' ' 114' ' ' VAL . 68.0 t80 -74.34 -34.07 63.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.532 0.682 . . . . 0.48999999999999999 109.316 172.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.868 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.92 -42.53 23.89 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.189 -0.914 . . . . 0.58999999999999997 111.565 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 110.616 -0.994 . . . . 1.6200000000000001 110.616 -170.841 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.762 ' CD1' ' HG2' ' A' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 121.655 0.74 . . . . 1.47 111.325 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 tmtp? -100.94 50.5 0.87 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.692 -1.14 . . . . 3.1499999999999999 109.435 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.456 ' CD1' HD12 ' A' ' 6' ' ' ILE . 0.9 OUTLIER 62.06 23.44 13.82 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 107.289 -1.374 . . . . 2.3500000000000001 107.289 -166.785 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.762 ' HG2' ' CD1' ' A' ' 1' ' ' PHE . 16.0 mm-40 46.64 17.79 0.06 Allowed 'General case' 0 C--N 1.344 0.335 0 N-CA-C 116.441 2.015 . . . . 4.1600000000000001 116.441 171.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.9 t70 48.97 29.98 2.59 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.47 0.652 . . . . 2.5699999999999998 109.9 -172.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.456 HD12 ' CD1' ' A' ' 3' ' ' TYR . 83.2 mt -52.71 132.75 46.78 Favored Pre-proline 0 CA--C 1.519 -0.229 0 CA-C-N 115.673 -0.694 . . . . 0.68999999999999995 110.376 -174.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -35.22 109.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 123.982 3.121 . . . . 0.59999999999999998 112.899 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.29 -17.02 51.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.59 -0.732 . . . . 0.56999999999999995 111.597 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -67.7 -35.46 78.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.703 . . . . 1.3700000000000001 109.275 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.493 ' HA ' HD13 ' A' ' 13' ' ' LEU . 41.4 t80 -89.1 -24.45 22.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.383 -1.28 . . . . 0.80000000000000004 111.098 -176.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -71.21 -22.93 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.041 -0.725 . . . . 1.73 109.041 177.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -24.52 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.774 -1.103 . . . . 1.02 110.541 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 10' ' ' TYR . 9.9 mp -80.37 -43.89 20.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.481 -0.781 . . . . 0.93000000000000005 110.669 178.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.406 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 69.8 mtm -68.36 131.54 91.77 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 1.1499999999999999 110.844 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.556 ' HD3' HD21 ' A' ' 139' ' ' LEU . 26.9 Cg_endo -63.24 152.44 79.78 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.90000000000000002 111.989 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 57.6 Cg_exo -53.08 -27.46 36.65 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.621 2.88 . . . . 0.95999999999999996 112.847 -178.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.56 ' O ' HD21 ' A' ' 66' ' ' LEU . 31.0 mt-10 -64.59 -50.17 68.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.898 -0.592 . . . . 1.8300000000000001 110.641 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.65 70.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.998 0.428 . . . . 0.81999999999999995 110.978 -178.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.406 ' HD2' ' O ' ' A' ' 14' ' ' MET . 41.0 mtp180 -75.64 -32.77 60.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.606 -0.725 . . . . 2.1600000000000001 110.505 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -52.5 -45.9 66.41 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.866 -0.606 . . . . 1.0600000000000001 111.318 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.528 ' O ' HD23 ' A' ' 25' ' ' LEU . 44.1 t80 -57.72 -63.21 1.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.952 -0.567 . . . . 0.65000000000000002 111.657 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.523 HD21 ' CE1' ' A' ' 100' ' ' TYR . 48.9 mt -73.45 -9.91 59.18 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 119.539 1.063 . . . . 1.1299999999999999 112.484 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.94 -36.89 80.9 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.013 0.435 . . . . 2.0600000000000001 110.059 164.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -80.47 -48.76 12.34 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.958 -0.564 . . . . 1.8400000000000001 111.142 -178.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.574 ' HB3' ' CE ' ' A' ' 30' ' ' LYS . 4.4 mm? -57.61 131.52 50.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.439 0.637 . . . . 1.05 111.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.6 m -130.79 -90.39 0.45 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.341 -0.845 . . . . 1.78 111.351 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -125.08 -62.13 1.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.086 0.402 . . . . 2.3900000000000001 112.086 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -61.75 -45.63 95.86 Favored Glycine 0 N--CA 1.453 -0.168 0 C-N-CA 121.101 -0.571 . . . . 0.93000000000000005 113.109 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.601 ' O ' HG12 ' A' ' 32' ' ' VAL . 11.7 m-20 -72.49 -32.61 66.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.22 0.533 . . . . 2.25 110.276 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.574 ' CE ' ' HB3' ' A' ' 25' ' ' LEU . 1.1 tppp? -55.54 -34.84 65.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 1.3100000000000001 111.049 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.6 m -51.99 -41.87 62.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.128 -0.942 . . . . 0.80000000000000004 112.292 176.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.601 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -86.68 -24.2 6.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.464 -0.335 . . . . 0.84999999999999998 111.49 -171.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.548 HD12 ' HE1' ' A' ' 37' ' ' PHE . 4.3 mm? -49.92 -53.08 28.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.789 0.328 . . . . 0.97999999999999998 111.873 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -64.06 -21.08 66.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 2.4100000000000001 111.373 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -76.66 -22.08 54.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.19 -0.459 . . . . 1.96 110.829 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.592 HG12 ' OH ' ' A' ' 42' ' ' TYR . 87.6 t -91.84 -52.3 10.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.578 0.704 . . . . 0.97999999999999998 110.189 177.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.548 ' HE1' HD12 ' A' ' 33' ' ' LEU . 64.8 m-85 -58.24 -39.58 79.5 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.941 1.089 . . . . 0.82999999999999996 113.941 177.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -85.07 16.89 3.2 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.847 -0.741 . . . . 2.1800000000000002 110.862 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.78 21.0 11.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.557 -0.747 . . . . 1.5600000000000001 109.945 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.77 -153.91 9.95 Favored Glycine 0 N--CA 1.452 -0.242 0 N-CA-C 111.32 -0.712 . . . . 1.54 111.32 174.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -83.52 150.64 65.58 Favored 'Cis proline' 0 C--N 1.344 0.318 0 CA-C-N 119.331 1.565 . . . . 1.6799999999999999 112.761 -2.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.592 ' OH ' HG12 ' A' ' 36' ' ' VAL . 13.7 m-85 -86.5 134.14 33.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.915 -0.584 . . . . 1.28 110.011 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -89.27 -17.36 29.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.315 -0.857 . . . . 3.5099999999999998 109.219 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.46 HD21 ' HG3' ' A' ' 47' ' ' GLU . 4.8 p30 -145.99 163.37 35.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.28 -0.873 . . . . 1.52 110.011 -177.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.0 m -65.55 -41.81 92.58 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 1.1799999999999999 111.436 -177.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -55.7 -34.92 65.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 2.2400000000000002 112.534 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.46 ' HG3' HD21 ' A' ' 44' ' ' ASN . 31.6 mt-10 -56.76 -39.49 74.13 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.034 0.383 . . . . 2.2599999999999998 112.034 -177.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.2 t -69.04 -43.87 73.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.958 0.409 . . . . 1.1899999999999999 109.931 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.1 mt -64.52 -44.11 96.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.692 -0.686 . . . . 0.55000000000000004 110.375 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.29 79.5 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.141 -0.936 . . . . 0.56999999999999995 112.069 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.424 ' CB ' HG13 ' A' ' 36' ' ' VAL . . . -64.99 -34.76 79.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.937 0.399 . . . . 0.5 110.81 -177.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 16.9 mt -69.49 -32.2 70.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.912 -0.586 . . . . 0.45000000000000001 111.318 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -67.44 -40.73 85.44 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.836 -0.346 . . . . 1.22 111.188 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -66.4 -28.51 68.68 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.223 0.535 . . . . 3.0499999999999998 110.869 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.537 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 40.3 mmtt -85.69 -44.12 12.83 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.892 -0.595 . . . . 1.48 112.043 176.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -151.5 103.93 2.91 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 120.712 -0.395 . . . . 1.1599999999999999 111.361 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -41.31 -62.69 0.37 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 123.87 3.047 . . . . 0.57999999999999996 113.485 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.36 -29.24 69.94 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.801 -1.09 . . . . 2.4500000000000002 111.387 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tt -73.22 -42.18 62.91 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.407 -0.96 . . . . 1.4199999999999999 108.407 -176.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.414 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -65.45 -25.6 71.44 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 114.353 -1.294 . . . . 0.37 111.467 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.78 -32.03 63.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.938 0.399 . . . . 0.47999999999999998 110.444 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -67.7 -37.99 83.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.282 -0.417 . . . . 2.1699999999999999 111.178 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.0 p -80.13 -29.56 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.176 0.512 . . . . 1.1200000000000001 110.061 175.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.15 -48.91 79.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.86 -0.609 . . . . 1.7 110.782 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.17 -30.57 71.16 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 121.397 0.617 . . . . 3.96 109.432 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -73.33 -3.85 29.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.075 -0.966 . . . . 1.5 111.872 -178.17 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -122.13 -29.68 4.17 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.126 -0.63 . . . . 2.3399999999999999 110.487 171.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.37 -47.34 64.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.659 0.244 . . . . 0.40000000000000002 111.659 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 35.7 mtm -62.63 -39.33 93.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.747 0.784 . . . . 0.71999999999999997 109.484 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.437 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 97.0 t -69.55 -35.49 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 114.709 -1.132 . . . . 0.79000000000000004 110.583 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.12 -39.65 90.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.947 -0.57 . . . . 1.47 110.568 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -55.44 -36.5 66.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.413 0.625 . . . . 1.26 110.371 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 43.7 mttp -77.69 -54.25 6.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.996 -1.002 . . . . 1.54 110.118 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.41 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.6 mt -61.76 -23.2 30.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.34000000000000002 111.361 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.82 65.5 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.66 -0.7 . . . . 0.34999999999999998 109.856 177.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.85 -2.98 52.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.813 -1.085 . . . . 0.48999999999999999 110.016 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.447 HD13 ' HB2' ' A' ' 135' ' ' GLN . 6.8 tp -91.23 135.46 33.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.001 -0.999 . . . . 0.70999999999999996 109.58 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.68 159.75 48.24 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.803 -0.713 . . . . 0.76000000000000001 111.829 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -47.73 -38.22 29.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.304 2.669 . . . . 1.5600000000000001 113.227 -177.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -63.53 -47.73 80.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.343 -0.39 . . . . 2.52 111.228 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -87.05 -29.79 21.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.104 -0.498 . . . . 0.35999999999999999 111.419 -174.406 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.41 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.0 ttpt -57.87 -41.74 83.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.09 -0.505 . . . . 2.04 111.319 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.09 -41.26 96.45 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.564 -0.826 . . . . 0.40999999999999998 112.083 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -71.57 -41.56 68.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.801 -0.2 . . . . 1.6499999999999999 111.057 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -57.81 -49.57 76.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.871 0.367 . . . . 0.40999999999999998 111.666 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.93 -29.3 69.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.353 -0.385 . . . . 1.96 111.522 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.4 OUTLIER -88.42 -38.29 15.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 111.743 0.275 . . . . 2.1200000000000001 111.743 -176.88 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.5 p -60.3 -39.8 88.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.101 0.477 . . . . 0.56999999999999995 109.769 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -63.82 -41.32 92.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.681 -0.69 . . . . 1.0900000000000001 110.879 175.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 8.0 pt-20 -67.16 -32.72 74.01 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.837 -0.345 . . . . 2.8199999999999998 110.736 -177.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 87' ' ' LYS . 74.3 mt -73.23 -52.31 22.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.82 0.343 . . . . 0.51000000000000001 110.546 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.8 -43.34 98.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.076 -0.511 . . . . 0.64000000000000001 111.206 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 12.3 ptt180 -66.3 -23.38 66.37 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.132 -0.485 . . . . 4.4199999999999999 110.454 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.0 -41.33 55.0 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.005 -0.617 . . . . 0.66000000000000003 112.137 -179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.0 mm -65.61 -44.39 93.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.818 0.818 . . . . 0.55000000000000004 109.125 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.4 ' HD2' HD12 ' A' ' 22' ' ' LEU . 14.8 ttpp -88.45 29.03 1.02 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.673 -1.148 . . . . 2.7000000000000002 109.887 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 93' ' ' ARG . . . -121.75 -34.48 3.39 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.113 -0.949 . . . . 0.63 110.567 168.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.626 ' O ' ' HB3' ' A' ' 103' ' ' ASN . 17.1 ptm180 -80.88 0.07 36.81 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 120.194 -0.602 . . . . 3.1000000000000001 109.498 176.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.475 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 5.6 m-85 -81.27 -28.78 34.56 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.024 -0.361 . . . . 0.96999999999999997 110.024 165.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.523 ' CE1' HD21 ' A' ' 22' ' ' LEU . 30.9 m-85 -72.44 -34.18 67.59 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.963 0.411 . . . . 1.48 111.272 -178.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.4 p -73.53 -12.08 60.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.659 -0.701 . . . . 0.87 112.554 -173.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.78 55.08 Favored Glycine 0 N--CA 1.453 -0.232 0 N-CA-C 111.103 -0.799 . . . . 1.1599999999999999 111.103 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 98' ' ' ARG . 40.6 t-20 -87.89 162.3 17.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.038 -1.097 . . . . 1.8300000000000001 108.038 176.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.401 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 20.6 mt-10 -139.46 97.92 8.26 Favored Pre-proline 0 C--N 1.32 -0.705 0 O-C-N 122.114 -0.366 . . . . 1.75 110.84 -178.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.7 Cg_endo -57.05 139.89 91.17 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.443 2.095 . . . . 0.53000000000000003 111.634 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.3 t -78.55 165.98 23.1 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.49 -0.559 . . . . 1.48 109.49 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.1 pttp -58.0 -33.78 69.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.279 0.561 . . . . 2.8799999999999999 110.373 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.97 -25.92 65.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.438 -0.801 . . . . 2.2400000000000002 111.015 -179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -67.81 -45.24 75.3 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.364 -0.606 . . . . 1.73 109.364 176.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.1 mp -63.77 -44.99 91.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.372 -0.831 . . . . 0.81999999999999995 110.4 177.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 30.1 mtpp -56.29 -42.41 77.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 1.74 110.432 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.26 77.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.572 -0.74 . . . . 0.46999999999999997 111.596 177.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.1 p -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.169 0.433 . . . . 1.3400000000000001 112.169 -177.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.916 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.4 m -77.73 -23.67 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.828 0.823 . . . . 0.65000000000000002 109.598 -177.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -67.19 -39.46 86.39 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.093 -0.958 . . . . 1.72 111.26 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 14.1 mm-40 -71.45 -34.32 70.13 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.463 -0.495 . . . . 2.27 110.772 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -65.78 -33.55 64.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.377 -0.529 . . . . 0.81000000000000005 109.932 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' A' ' 149' ' ' ALA . 62.8 mt -72.18 -33.94 68.06 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.76 -0.459 . . . . 1.21 109.76 174.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.1 ttpt -56.93 -44.24 82.3 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.891 -0.781 . . . . 0.94999999999999996 108.891 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.4 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.6 mp -70.91 -48.52 53.18 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.872 -1.058 . . . . 1.0600000000000001 111.467 174.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 129' ' ' LYS . 51.0 t80 -71.24 -30.87 66.86 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 119.498 -0.881 . . . . 1.54 111.526 -167.373 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -66.84 -35.05 79.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.032 0.444 . . . . 1.98 110.793 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -88.58 -10.21 49.54 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.88 0.696 . . . . 0.69999999999999996 112.88 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.5 mtm -71.15 156.36 39.67 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.837 -0.345 . . . . 0.5 111.692 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.434 ' O ' ' HG2' ' A' ' 129' ' ' LYS . 46.8 t -53.2 141.15 24.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.001 -0.545 . . . . 1.1799999999999999 110.155 173.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.37 -48.9 77.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.816 0.341 . . . . 2.21 110.924 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.66 75.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.541 . . . . 0.41999999999999998 110.815 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -73.13 -44.59 35.0 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.751 -0.659 . . . . 0.31 112.607 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 121' ' ' TYR . 14.1 ptmm? -71.15 -29.08 64.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.989 0.423 . . . . 1.3200000000000001 110.918 -177.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.37 65.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.41999999999999998 110.985 174.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.33 -27.91 67.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.296 0.57 . . . . 0.55000000000000004 109.702 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.49 -25.21 67.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.224 -0.898 . . . . 0.39000000000000001 110.529 174.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.501 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -75.07 -12.48 83.39 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.891 -0.671 . . . . 0.27000000000000002 113.344 -177.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -90.52 -48.23 7.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.434 0.635 . . . . 2.4300000000000002 110.01 -178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.447 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -79.8 -31.97 40.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.115 -0.948 . . . . 1.8300000000000001 110.732 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.437 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 5.9 m-85 -124.75 74.64 64.36 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.786 0.327 . . . . 0.68999999999999995 110.755 175.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.14 -33.97 23.49 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.954 2.436 . . . . 0.63 112.948 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 37.3 t80 -73.93 -42.38 60.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.724 0.297 . . . . 2.3100000000000001 110.718 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.556 HD21 ' HD3' ' A' ' 15' ' ' PRO . 58.2 mt -70.92 -44.27 66.53 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.942 -0.303 . . . . 1.02 110.624 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.501 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -59.36 -39.42 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.34999999999999998 110.148 178.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.2 tttm -46.12 -65.75 0.5 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.315 -0.857 . . . . 2.5800000000000001 111.456 172.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.19 -18.59 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.391 -0.822 . . . . 0.5 112.883 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 18.6 m-85 -81.75 -41.99 20.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.103 -0.639 . . . . 0.62 110.933 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -70.32 -39.17 74.92 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.115 0.483 . . . . 2.5800000000000001 110.6 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.0 t -83.95 161.66 20.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.615 -0.721 . . . . 1.3200000000000001 109.306 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.67 57.74 3.82 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.626 -0.797 . . . . 1.0900000000000001 112.678 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -106.55 -69.18 0.84 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.798 -0.445 . . . . 1.98 109.798 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.04 -40.69 87.23 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.057 0.456 . . . . 0.34000000000000002 109.783 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -56.99 -43.52 81.78 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.521 -0.763 . . . . 0.51000000000000001 110.652 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.02 -38.56 86.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.052 0.453 . . . . 2.8199999999999998 110.413 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -67.52 -34.37 76.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.615 -0.72 . . . . 0.48999999999999999 111.305 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.916 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -89.37 -37.26 14.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.933 0.716 . . . . 0.58999999999999997 112.933 -174.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.472 0 N-CA-C 110.814 -0.914 . . . . 1.6200000000000001 110.814 -169.839 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.104 0.478 . . . . 1.47 110.483 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HB3' ' OD1' ' A' ' 5' ' ' ASP . 75.3 tttt -135.62 158.1 45.23 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.043 -0.725 . . . . 3.1499999999999999 109.043 170.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -49.27 -51.52 33.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.167 0.508 . . . . 2.3500000000000001 110.288 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.32 -20.34 66.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.245 -0.889 . . . . 4.1600000000000001 112.405 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.537 ' OD1' ' HB3' ' A' ' 2' ' ' LYS . 2.6 m-20 -88.58 -18.8 27.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.865 0.364 . . . . 2.5699999999999998 110.971 -175.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.2 mt -72.86 131.25 84.19 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.795 -0.817 . . . . 0.68999999999999995 108.795 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -41.33 113.28 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.217 2.611 . . . . 0.59999999999999998 112.163 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -19.65 65.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.798 . . . . 0.56999999999999995 112.218 -171.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.44 -33.47 76.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.773 0.797 . . . . 1.3700000000000001 109.372 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.81 -37.29 22.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.201 -1.363 . . . . 0.80000000000000004 111.502 -175.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -66.13 -31.87 72.99 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.798 -0.815 . . . . 1.73 108.798 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -15.29 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.042 -1.435 . . . . 1.02 111.908 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.4 mt -92.28 -33.95 14.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.721 0.296 . . . . 0.93000000000000005 110.688 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.518 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 70.3 mtm -70.19 142.56 90.09 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 1.1499999999999999 111.191 -176.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.65 149.13 60.75 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.65 2.234 . . . . 0.90000000000000002 111.906 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -44.37 -49.39 8.98 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.866 3.044 . . . . 0.95999999999999996 113.599 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' HD21 ' A' ' 66' ' ' LEU . 46.5 mt-10 -59.05 -43.25 91.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.688 0.28 . . . . 1.8300000000000001 111.703 -176.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.83 -7.12 49.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.81999999999999995 111.227 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.518 ' HD2' ' O ' ' A' ' 14' ' ' MET . 62.2 mtp180 -101.01 -32.54 10.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.85 -0.614 . . . . 2.1600000000000001 110.189 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.81 -46.31 50.91 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.854 -0.612 . . . . 1.0600000000000001 111.392 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 25' ' ' LEU . 58.0 t80 -56.24 -56.59 19.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.965 -0.561 . . . . 0.65000000000000002 111.526 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -78.66 -7.52 57.75 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.609 1.095 . . . . 1.1299999999999999 111.984 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -70.97 -32.86 69.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.93 0.395 . . . . 2.0600000000000001 110.152 164.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -82.67 -49.6 9.62 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.737 -0.665 . . . . 1.8400000000000001 112.244 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 21' ' ' PHE . 2.9 mm? -52.26 134.15 33.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.382 0.61 . . . . 1.05 111.005 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.1 t -130.01 -69.55 0.67 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.444 -0.798 . . . . 1.78 111.289 -174.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -141.24 -78.07 0.28 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.193 0.442 . . . . 2.3900000000000001 112.193 -172.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.405 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -62.75 -30.84 78.19 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.93000000000000005 112.594 -174.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -66.9 -51.69 52.3 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.636 -0.282 . . . . 2.25 110.898 176.694 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 87.7 mttt -56.87 -27.31 60.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.116 0.484 . . . . 1.3100000000000001 110.886 176.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 45.3 m -65.2 -26.92 68.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.774 . . . . 0.80000000000000004 110.717 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.9 p -98.27 -23.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 120.64 -0.424 . . . . 0.84999999999999998 110.808 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.402 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -54.07 -50.36 66.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.74 -0.209 . . . . 0.97999999999999998 111.14 171.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 0.0 OUTLIER -64.97 -25.48 67.89 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.726 0.298 . . . . 2.4100000000000001 111.712 -177.204 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 9.0 mm-40 -68.97 -39.12 79.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.348 -0.387 . . . . 1.96 110.281 175.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.75 -50.66 42.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.936 -0.574 . . . . 0.97999999999999998 110.379 178.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.406 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 20.4 m-85 -54.6 -46.45 73.8 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 114.066 1.135 . . . . 0.82999999999999996 114.066 177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -84.6 7.86 18.74 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.662 -0.815 . . . . 2.1800000000000002 111.201 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.27 12.24 32.03 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.087 -0.709 . . . . 1.5600000000000001 109.087 171.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -97.27 -152.26 28.45 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.209 -0.905 . . . . 1.54 111.242 175.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.74 153.65 95.54 Favored 'Cis proline' 0 C--N 1.344 0.3 0 CA-C-N 119.088 1.444 . . . . 1.6799999999999999 112.655 -0.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.574 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 98.6 m-85 -103.83 140.65 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.86 -0.609 . . . . 1.28 110.095 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -76.58 -15.73 59.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.464 -0.789 . . . . 3.5099999999999998 110.239 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.94 148.08 25.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.713 -0.676 . . . . 1.52 110.327 -177.045 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.8 t -68.91 -18.66 64.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.074 -0.512 . . . . 1.1799999999999999 111.525 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -57.12 -46.35 82.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.902 0.382 . . . . 2.2400000000000002 110.739 176.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.574 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.2 OUTLIER -63.6 -29.74 70.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.038 -0.528 . . . . 2.2599999999999998 111.367 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.0 t -72.43 -42.1 65.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.722 -0.473 . . . . 1.1899999999999999 109.722 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.84 -46.36 88.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.776 -0.647 . . . . 0.55000000000000004 110.205 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.42 -49.51 67.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.182 -0.917 . . . . 0.56999999999999995 111.673 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.79 82.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.183 0.516 . . . . 0.5 110.788 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.402 HD21 HD13 ' A' ' 33' ' ' LEU . 48.1 mt -69.73 -37.06 76.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 0.45000000000000001 111.086 -179.312 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -62.91 -38.74 92.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.915 0.388 . . . . 1.22 111.67 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.154 0.502 . . . . 3.0499999999999998 110.988 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 22.6 mmtt -77.41 -46.49 22.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.827 -0.624 . . . . 1.48 111.852 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.47 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 68.6 m -146.11 97.01 4.52 Favored Pre-proline 0 C--N 1.315 -0.918 0 N-CA-C 110.108 -0.33 . . . . 1.1599999999999999 110.108 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 5.7 Cg_endo -47.5 -62.94 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.855 3.036 . . . . 0.57999999999999996 113.553 -167.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 11.2 pt-20 -67.14 -25.55 66.24 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.162 -0.926 . . . . 2.4500000000000002 111.749 -177.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 59' ' ' LEU . 2.0 tm? -74.29 -41.67 60.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.529 -0.915 . . . . 1.4199999999999999 108.529 -177.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.9 -23.71 77.75 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 114.596 -1.183 . . . . 0.37 111.639 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.28 -32.51 71.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.804 0.335 . . . . 0.47999999999999998 110.454 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 67.9 mttm -64.93 -49.85 68.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 2.1699999999999999 110.766 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.27 -29.9 48.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.925 0.393 . . . . 1.1200000000000001 110.348 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.79 -61.66 2.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.539 . . . . 1.7 111.002 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.9 mptt -59.78 -37.07 78.06 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.11 0.481 . . . . 3.96 110.596 -174.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.3 tm? -64.61 -43.7 92.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.123 -0.944 . . . . 1.5 110.278 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 t60 -78.82 -32.97 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.321 -0.622 . . . . 2.3399999999999999 109.321 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.51 98.59 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.12 -0.946 . . . . 0.40000000000000002 111.832 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 61.5 mtm -59.83 -51.08 71.27 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.411 0.624 . . . . 0.71999999999999997 110.06 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 66' ' ' LEU . 97.1 t -57.02 -43.58 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 114.786 -1.097 . . . . 0.79000000000000004 110.687 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.4 mmmt -61.12 -38.84 87.8 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.92 -0.582 . . . . 1.47 111.386 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -63.17 -37.22 86.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.26 0.553 . . . . 1.26 110.801 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.35 -43.37 64.15 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 1.54 110.416 177.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 72.0 mt -67.99 -22.5 27.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.477 0.656 . . . . 0.34000000000000002 110.245 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.04 -36.25 72.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.931 0.872 . . . . 0.34999999999999998 109.851 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.01 -2.08 55.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.301 -1.318 . . . . 0.48999999999999999 110.27 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 8.5 tp -92.01 137.03 32.7 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.70999999999999996 109.605 -176.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.39 156.66 52.21 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.755 -0.736 . . . . 0.76000000000000001 111.964 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -44.29 -41.43 13.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.86 3.04 . . . . 1.5600000000000001 114.235 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -67.43 -50.22 60.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.71 0.291 . . . . 2.52 110.76 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -76.24 -31.35 58.31 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.258 -0.577 . . . . 0.35999999999999999 110.297 -176.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 40.7 ttmt -58.35 -45.58 87.92 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.475 -0.784 . . . . 2.04 111.187 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.12 -40.85 96.17 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.899 -0.667 . . . . 0.40999999999999998 112.177 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.5 t80 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.99 -0.105 . . . . 1.6499999999999999 111.278 177.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -55.51 -44.92 77.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.95 0.405 . . . . 0.40999999999999998 111.657 -175.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 40.6 mt-10 -71.19 -22.26 62.04 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.544 -0.462 . . . . 1.96 110.846 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -79.5 -40.3 30.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.619 -0.264 . . . . 2.1200000000000001 111.249 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.3 p -61.78 -27.04 68.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.061 0.457 . . . . 0.56999999999999995 110.3 176.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -74.34 -50.51 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.918 -0.583 . . . . 1.0900000000000001 110.132 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 42.1 mt-10 -58.23 -53.64 55.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.191 0.441 . . . . 2.8199999999999998 112.191 -177.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.72 -45.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.276 -0.42 . . . . 0.51000000000000001 111.218 -174.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.523 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.63 -40.88 84.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.64000000000000001 110.872 179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -63.5 -31.05 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.87 -0.605 . . . . 4.4199999999999999 110.673 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.14 -36.15 89.82 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.782 -0.723 . . . . 0.66000000000000003 111.896 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.436 HG13 ' CB ' ' A' ' 113' ' ' SER . 43.9 mm -67.66 -50.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.058 0.456 . . . . 0.55000000000000004 110.42 178.243 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 39.4 pttt -82.12 0.19 41.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.159 -0.473 . . . . 2.7000000000000002 111.646 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.52 -27.99 60.78 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.127 -0.694 . . . . 0.63 109.127 164.226 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.503 ' HA ' ' HG1' ' A' ' 101' ' ' THR . 66.6 mtp180 -86.69 -7.61 58.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.679 -0.691 . . . . 3.1000000000000001 109.579 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -81.89 -41.36 21.05 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.349 -0.611 . . . . 0.96999999999999997 109.349 167.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 32.5 m-85 -63.39 -50.11 71.16 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.201 0.524 . . . . 1.48 110.981 178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.503 ' HG1' ' HA ' ' A' ' 98' ' ' ARG . 17.5 p -66.78 -14.43 62.6 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.321 0.86 . . . . 0.87 113.321 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 94.13 3.43 63.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.689 -0.767 . . . . 1.1599999999999999 113.184 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 37.0 m-80 -98.51 68.31 1.83 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.2 -0.296 . . . . 1.8300000000000001 110.2 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -52.31 119.65 15.47 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.709 -0.678 . . . . 1.75 112.318 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.22 163.38 38.86 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.589 2.859 . . . . 0.53000000000000003 112.722 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 67.3 p -85.77 173.52 9.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.116 -0.493 . . . . 1.48 109.865 174.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -66.59 -27.83 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.19 -0.67 . . . . 2.8799999999999999 109.19 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.43 -40.23 93.66 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.286 -0.87 . . . . 2.2400000000000002 110.782 177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -59.04 -44.71 91.8 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.876 0.37 . . . . 1.73 110.588 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.561 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -67.66 -46.13 73.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.81999999999999995 110.835 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.435 ' O ' HG22 ' A' ' 114' ' ' VAL . 61.8 mtpt -55.77 -45.86 78.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.261 0.553 . . . . 1.74 110.101 177.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -62.07 -43.5 98.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.441 -0.799 . . . . 0.46999999999999997 111.692 178.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.436 ' CB ' HG13 ' A' ' 95' ' ' ILE . 57.9 p -64.92 -36.2 83.6 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.002 0.371 . . . . 1.3400000000000001 112.002 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.797 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -78.62 -25.12 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 109.024 -0.732 . . . . 0.65000000000000002 109.024 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 45.5 mttm -61.53 -45.81 92.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.221 -0.899 . . . . 1.72 111.408 176.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.625 ' O ' HD13 ' A' ' 120' ' ' LEU . 22.3 mm-40 -71.01 -38.7 72.63 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.582 -0.447 . . . . 2.27 110.457 -174.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.523 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.9 m -62.85 -38.5 82.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.483 -0.487 . . . . 0.81000000000000005 110.265 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.615 HD13 ' HA ' ' A' ' 149' ' ' ALA . 41.2 mt -78.49 -26.68 46.05 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.079 -0.388 . . . . 1.21 111.358 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -61.98 -48.54 79.88 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.525 -0.917 . . . . 0.94999999999999996 108.525 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -65.78 -43.82 87.62 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.072 -1.422 . . . . 1.0600000000000001 111.667 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.472 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 47.7 t80 -72.03 -37.52 69.73 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 120.315 -0.554 . . . . 1.54 111.291 -170.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' A' ' 118' ' ' LEU . 5.8 mptp? -59.75 -31.97 70.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.47 . . . . 1.98 111.052 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.44 -5.68 59.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.593 -0.731 . . . . 0.69999999999999996 112.608 -174.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -77.39 156.69 31.02 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.048 -0.661 . . . . 0.5 110.389 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.7 t -67.23 152.05 46.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.639 -0.504 . . . . 1.1799999999999999 109.639 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -54.72 -42.42 71.5 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.814 0.34 . . . . 2.21 111.254 -175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.04 -30.39 71.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.41999999999999998 111.044 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.92 -37.46 50.49 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.217 -0.753 . . . . 0.31 111.217 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -63.08 -45.63 91.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.195 0.521 . . . . 1.3200000000000001 109.986 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.59 84.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.426 -0.807 . . . . 0.41999999999999998 111.41 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 134' ' ' LYS . 24.7 t70 -73.84 -30.63 62.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.292 0.567 . . . . 0.55000000000000004 109.774 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -64.52 -26.07 68.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.008 -0.542 . . . . 0.39000000000000001 110.228 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.46 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.96 -14.8 79.99 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 114.243 0.457 . . . . 0.27000000000000002 114.243 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -95.53 -34.18 12.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.518 0.659 . . . . 2.4300000000000002 111.408 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -89.64 -28.73 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.768 -0.651 . . . . 1.8300000000000001 110.695 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -128.9 72.96 81.74 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.296 -0.411 . . . . 0.68999999999999995 110.168 172.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -61.2 -44.76 22.05 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.832 2.355 . . . . 0.63 112.922 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.527 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 34.8 t80 -66.87 -35.6 80.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 2.3100000000000001 111.263 -174.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 56.9 mt -74.01 -44.06 55.82 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.614 -0.434 . . . . 1.02 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.46 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -61.15 -32.72 72.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.409 0.623 . . . . 0.34999999999999998 110.065 176.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.2 tttm -55.18 -70.84 0.09 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.926 -1.034 . . . . 2.5800000000000001 110.963 171.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.487 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.9 m -60.37 -30.29 46.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 112.966 0.728 . . . . 0.5 112.966 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.28 -54.4 14.87 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.248 -0.581 . . . . 0.62 110.657 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -79.22 -19.19 51.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 2.5800000000000001 112.088 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.1 t -85.48 3.45 40.24 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.992 0.425 . . . . 1.3200000000000001 110.58 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 149' ' ' ALA . . . 75.54 16.83 80.39 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.803 -0.713 . . . . 1.0900000000000001 112.804 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -79.45 -62.38 1.71 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.836 0.351 . . . . 1.98 110.112 -178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -70.75 -37.14 73.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.094 -0.503 . . . . 0.34000000000000002 110.006 176.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.615 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -54.56 -37.45 65.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.284 -0.871 . . . . 0.51000000000000001 111.82 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 150' ' ' LYS . 45.3 tptt -82.8 -23.79 33.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.902 0.382 . . . . 2.8199999999999998 110.697 -177.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.42 ' HD2' HG21 ' A' ' 114' ' ' VAL . 50.2 t80 -72.48 -29.16 63.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 0.48999999999999999 109.823 174.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.797 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.62 -35.08 19.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.903 -0.589 . . . . 0.58999999999999997 110.826 176.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 110.533 -1.027 . . . . 1.6200000000000001 110.533 -172.355 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 24.1 p90 . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.148 0.499 . . . . 1.47 110.855 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -105.48 136.12 45.63 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.376 -0.601 . . . . 3.1499999999999999 109.376 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -65.23 -35.27 80.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.85 0.357 . . . . 2.3500000000000001 110.737 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -73.1 -5.75 41.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.451 -0.34 . . . . 4.1600000000000001 111.753 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -87.92 -10.93 49.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.401 0.619 . . . . 2.5699999999999998 109.848 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 68.1 mt -79.31 134.69 58.42 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.499 -0.926 . . . . 0.68999999999999995 108.499 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -41.78 113.58 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.184 2.589 . . . . 0.59999999999999998 112.123 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -17.99 65.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.723 -0.671 . . . . 0.56999999999999995 111.768 -172.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 7.4 m-20 -65.27 -31.21 72.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.936 0.874 . . . . 1.3700000000000001 109.426 178.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 75.0 t80 -85.06 -28.89 25.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.036 -1.438 . . . . 0.80000000000000004 110.313 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.495 ' HA ' ' HG2' ' A' ' 14' ' ' MET . 58.7 mtp180 -72.02 -25.05 61.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.84 0.829 . . . . 1.73 108.849 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -71.53 -18.99 62.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.172 -1.376 . . . . 1.02 110.661 174.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 9' ' ' ASP . 72.1 mt -91.39 -48.48 6.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.93000000000000005 111.124 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.495 ' HG2' ' HA ' ' A' ' 11' ' ' ARG . 17.5 ptp -63.23 133.38 95.43 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 120.979 0.419 . . . . 1.1499999999999999 109.994 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD3' HD21 ' A' ' 139' ' ' LEU . 65.8 Cg_endo -74.26 163.81 35.61 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.602 2.201 . . . . 0.90000000000000002 112.385 -175.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -43.83 -41.74 11.88 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.93 2.42 . . . . 0.95999999999999996 112.697 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.7 -34.5 18.87 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.438 -0.801 . . . . 1.8300000000000001 112.122 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.53 -19.25 19.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.717 0.294 . . . . 0.81999999999999995 111.25 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.455 ' HG2' ' SD ' ' A' ' 14' ' ' MET . 19.0 mtm180 -88.46 -42.48 12.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.382 -0.372 . . . . 2.1600000000000001 111.393 -176.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.54 -40.74 60.25 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 123.242 0.339 . . . . 1.0600000000000001 111.832 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.609 ' O ' HD23 ' A' ' 25' ' ' LEU . 32.5 t80 -61.34 -58.97 6.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 119.005 -0.522 . . . . 0.65000000000000002 111.332 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.418 HD11 ' HE1' ' A' ' 100' ' ' TYR . 32.5 mt -73.41 -11.92 60.64 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.814 1.188 . . . . 1.1299999999999999 112.192 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -67.86 -39.29 83.79 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.622 -0.51 . . . . 2.0600000000000001 109.622 164.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -69.96 -50.43 41.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.866 -0.607 . . . . 1.8400000000000001 111.109 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.609 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -59.32 141.97 53.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.31 0.576 . . . . 1.05 111.289 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -141.26 -83.03 0.21 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.491 -0.777 . . . . 1.78 110.456 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.93 158.73 43.8 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.999 -0.741 . . . . 2.3900000000000001 108.999 176.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.52 -51.4 3.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.894 -0.67 . . . . 0.93000000000000005 112.833 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 7.8 m-20 -68.75 -43.89 74.87 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.787 -0.243 . . . . 2.25 111.14 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.47 -20.03 62.69 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.0 0.429 . . . . 1.3100000000000001 111.031 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.3 m -63.74 -39.98 95.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.80000000000000004 110.975 177.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.7 p -80.85 -27.04 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 116.186 -0.461 . . . . 0.84999999999999998 110.34 -176.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.572 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.4 mm? -54.49 -56.41 19.11 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.279 -0.419 . . . . 0.97999999999999998 111.329 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -60.93 -25.23 66.63 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.921 0.341 . . . . 2.4100000000000001 111.921 -175.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -74.19 -15.4 61.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.969 0.414 . . . . 1.96 111.339 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 82.6 t -90.38 -48.1 14.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.575 0.702 . . . . 0.97999999999999998 109.317 173.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.572 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 52.6 m-85 -55.1 -45.09 75.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.637 -1.165 . . . . 0.82999999999999996 114.018 176.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.12 14.15 5.41 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.952 -0.699 . . . . 2.1800000000000002 111.557 -176.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.51 -77.25 0.59 Allowed 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.556 -0.747 . . . . 1.5600000000000001 109.846 173.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.508 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 45.82 -150.72 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.795 -0.716 . . . . 1.54 112.684 -174.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.3 Cg_endo -91.84 148.99 16.0 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.096 -1.21 . . . . 1.6799999999999999 111.06 -9.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.508 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 23.4 m-85 -116.79 122.13 43.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.457 0.646 . . . . 1.28 111.067 -171.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.592 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 6.9 ptpp? -88.39 -7.02 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.91 -1.041 . . . . 3.5099999999999998 109.948 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.586 HD21 ' HG3' ' A' ' 47' ' ' GLU . 8.2 p30 -151.83 162.63 40.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.67 -0.696 . . . . 1.52 109.654 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 25.9 m -69.38 -32.66 71.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.392 -0.367 . . . . 1.1799999999999999 111.19 -177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 46.3 mt-10 -59.59 -38.33 80.94 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.073 -0.512 . . . . 2.2400000000000002 111.313 -176.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.592 ' OE1' ' HG2' ' A' ' 43' ' ' LYS . 34.0 mt-10 -57.87 -42.76 85.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.955 0.407 . . . . 2.2599999999999998 111.403 177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -70.99 -37.48 72.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.141 -0.481 . . . . 1.1899999999999999 110.148 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 45' ' ' THR . 69.9 mt -65.98 -42.65 92.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.088 -0.505 . . . . 0.55000000000000004 110.093 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.02 75.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.339 -0.846 . . . . 0.56999999999999995 111.025 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.49 90.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.871 -0.604 . . . . 0.5 110.396 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.552 HD21 HD13 ' A' ' 33' ' ' LEU . 24.9 mt -67.23 -40.76 86.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.135 -0.939 . . . . 0.45000000000000001 111.174 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.51 -32.68 72.72 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.809 0.338 . . . . 1.22 111.004 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -77.27 -46.8 21.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 3.0499999999999998 110.596 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.511 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.1 mmtt -68.52 -49.46 59.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.024 -0.535 . . . . 1.48 111.858 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 m -147.5 92.26 4.85 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 109.853 -0.425 . . . . 1.1599999999999999 109.853 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -37.39 -56.75 0.8 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 124.593 3.529 . . . . 0.57999999999999996 114.096 -172.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.68 -28.89 69.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.409 -0.814 . . . . 2.4500000000000002 112.148 -175.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 33.8 mt -72.63 -37.9 67.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.755 0.788 . . . . 1.4199999999999999 109.022 -178.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.27 -36.41 89.6 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 114.526 -1.215 . . . . 0.37 111.229 174.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.595 ' O ' ' HD3' ' A' ' 65' ' ' LYS . . . -61.15 -41.19 96.31 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.348 -0.241 . . . . 0.47999999999999998 110.348 174.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 42.6 mmtm -50.89 -63.65 1.06 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.261 0.553 . . . . 2.1699999999999999 110.375 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.2 m -67.49 -27.69 39.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.048 -0.978 . . . . 1.1200000000000001 111.747 -172.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.15 -45.85 79.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.826 0.346 . . . . 1.7 111.193 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -76.62 -34.88 58.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.742 0.782 . . . . 3.96 109.448 179.184 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.44 -48.11 68.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.593 -1.185 . . . . 1.5 112.047 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -72.93 -25.92 61.21 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.842 -0.799 . . . . 2.3399999999999999 108.842 -175.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.84 -35.3 80.28 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 114.68 -1.146 . . . . 0.40000000000000002 111.225 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.4 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 36.4 mtm -62.48 -49.96 73.31 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.139 -0.689 . . . . 0.71999999999999997 109.139 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.424 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 67.4 t -54.22 -48.81 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 114.707 -1.133 . . . . 0.79000000000000004 110.268 176.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -63.6 -43.08 97.98 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.485 -0.78 . . . . 1.47 112.403 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.5 m -64.88 -30.53 71.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.855 0.359 . . . . 1.26 111.303 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.5 mtmt -77.79 -36.26 50.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.428 -0.351 . . . . 1.54 110.232 176.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.89 -24.83 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.505 0.669 . . . . 0.34000000000000002 110.319 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.92 70.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.804 0.811 . . . . 0.34999999999999998 109.798 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.47 -0.63 57.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.562 -1.199 . . . . 0.48999999999999999 110.709 -179.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.3 tp -94.79 135.48 36.23 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.851 -0.613 . . . . 0.70999999999999996 109.944 -178.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.44 144.43 48.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.72 -0.752 . . . . 0.76000000000000001 111.929 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -33.8 -43.3 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 125.067 3.845 . . . . 1.5600000000000001 115.199 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -64.76 -52.73 55.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.941 0.4 . . . . 2.52 110.591 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.5 -31.55 53.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.41 0.624 . . . . 0.35999999999999999 109.946 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -57.84 -46.26 85.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.772 -1.104 . . . . 2.04 111.118 176.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.91 -40.2 98.54 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.648 -0.787 . . . . 0.40999999999999998 111.574 177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -65.3 -46.57 79.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.603 -0.299 . . . . 1.6499999999999999 110.804 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.35 -46.0 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.039 0.447 . . . . 0.40999999999999998 111.198 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -60.04 -38.42 82.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.3 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.443 ' HD2' HD11 ' A' ' 91' ' ' ILE . 4.3 tmtp? -77.61 -46.45 22.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.123 -0.231 . . . . 2.1200000000000001 110.65 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 p -63.37 -43.05 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.753 0.311 . . . . 0.56999999999999995 111.165 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -62.03 -40.36 87.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 1.0900000000000001 110.354 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -66.76 -35.52 80.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.493 -0.321 . . . . 2.8199999999999998 111.42 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.443 HD11 ' HD2' ' A' ' 87' ' ' LYS . 94.8 mt -63.87 -45.72 96.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.723 0.297 . . . . 0.51000000000000001 110.513 177.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.683 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -64.95 -42.44 94.62 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.697 -0.482 . . . . 0.64000000000000001 109.697 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -59.48 -34.06 72.09 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.556 -0.747 . . . . 4.4199999999999999 111.265 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.69 -39.55 86.13 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.958 -0.639 . . . . 0.66000000000000003 112.287 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.467 HD11 ' OG ' ' A' ' 113' ' ' SER . 29.6 mm -66.45 -49.67 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.166 0.508 . . . . 0.55000000000000004 109.672 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.5 ptmm? -83.87 36.01 0.54 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.61 0.719 . . . . 2.7000000000000002 110.114 175.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.1 -32.92 3.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.949 -1.023 . . . . 0.63 109.842 165.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -88.0 -3.48 58.9 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.137 -0.483 . . . . 3.1000000000000001 110.315 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 28.2 m-85 -88.32 -31.23 19.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.16 0.505 . . . . 0.96999999999999997 109.778 166.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.454 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 4.5 m-85 -66.74 -34.57 78.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.722 -0.672 . . . . 1.48 111.765 -176.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 p -73.63 -0.42 15.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.756 -0.657 . . . . 0.87 112.644 -174.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.86 9.48 64.03 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.688 -0.768 . . . . 1.1599999999999999 111.945 -175.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -105.28 177.3 4.89 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.851 -0.426 . . . . 1.8300000000000001 109.851 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 56.8 mt-10 -141.59 100.65 6.13 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.611 -0.268 . . . . 1.75 111.396 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.452 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 9.6 Cg_endo -56.96 132.83 54.07 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 121.987 1.791 . . . . 0.53000000000000003 110.078 167.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -76.03 173.51 11.18 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.313 -0.555 . . . . 1.48 110.157 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 86.0 tttt -60.13 -33.12 71.71 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.767 -0.373 . . . . 2.8799999999999999 110.366 -175.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -58.32 -40.87 83.2 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.819 -0.628 . . . . 2.2400000000000002 110.864 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.02 -47.55 84.8 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.124 -0.489 . . . . 1.73 110.544 177.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.498 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.7 mp -65.4 -45.98 81.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.715 -0.675 . . . . 0.81999999999999995 110.713 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 151' ' ' PHE . 59.9 mtpt -55.16 -51.32 66.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.03 0.443 . . . . 1.74 110.481 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.554 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -60.96 -41.26 96.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.543 -0.753 . . . . 0.46999999999999997 111.2 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.467 ' OG ' HD11 ' A' ' 95' ' ' ILE . 50.4 m -65.13 -43.08 93.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.216 -0.447 . . . . 1.3400000000000001 112.04 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.517 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.2 m -76.15 -29.88 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.596 0.712 . . . . 0.65000000000000002 109.646 -176.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.4 ptmt -72.47 -26.11 61.68 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.13 -0.941 . . . . 1.72 110.624 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.569 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.8 tt0 -76.83 -33.7 57.93 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 109.262 -0.644 . . . . 2.27 109.262 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 114' ' ' VAL . 93.6 t -58.42 -47.72 87.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.424 0.63 . . . . 0.81000000000000005 110.198 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.582 ' O ' ' HG3' ' A' ' 122' ' ' LYS . 7.7 mt -69.41 -26.14 64.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.62 -0.718 . . . . 1.21 110.37 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 34.3 ttpt -62.62 -43.99 97.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.677 -0.86 . . . . 0.94999999999999996 108.677 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.77 -45.95 66.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.839 -1.073 . . . . 1.0600000000000001 111.841 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -36.12 70.99 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 118.929 -1.108 . . . . 1.54 111.833 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 29.8 mttp -64.39 -30.3 71.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.057 0.456 . . . . 1.98 110.49 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -6.38 58.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 0.69999999999999996 112.352 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.6 mtm -77.37 158.38 30.13 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.224 -0.591 . . . . 0.5 110.317 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.5 m -65.15 152.11 44.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.338 -0.245 . . . . 1.1799999999999999 110.338 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -57.18 -42.15 80.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.725 0.298 . . . . 2.21 111.181 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.2 -29.65 70.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.41999999999999998 110.956 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.25 -38.66 53.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.942 -0.572 . . . . 0.31 111.932 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -61.51 -45.54 93.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.474 0.654 . . . . 1.3200000000000001 109.514 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.18 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.05 -0.977 . . . . 0.41999999999999998 110.966 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -74.24 -34.35 63.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.047 -0.524 . . . . 0.55000000000000004 109.669 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.06 -34.03 76.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.722 -0.672 . . . . 0.39000000000000001 110.098 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.43 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -63.9 -22.3 66.4 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.94 -0.573 . . . . 0.27000000000000002 113.318 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -85.81 -19.38 30.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 2.4300000000000002 111.386 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -105.45 -37.2 6.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 1.8300000000000001 110.991 -177.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.424 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 77.8 m-85 -129.23 73.58 81.59 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.932 0.396 . . . . 0.68999999999999995 110.059 175.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.47 -30.78 72.08 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.885 2.39 . . . . 0.63 112.388 -175.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 36.2 t80 -69.63 -39.53 77.09 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.439 . . . . 2.3100000000000001 110.242 -178.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.465 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 71.0 mt -77.62 -44.14 29.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.301 -0.408 . . . . 1.02 110.75 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.43 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.29 -39.03 74.91 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.744 -0.465 . . . . 0.34999999999999998 109.744 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.571 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.2 tttt -45.62 -71.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.04 -0.982 . . . . 2.5800000000000001 111.444 171.127 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -67.06 -25.24 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.489 -0.778 . . . . 0.5 112.706 -172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.465 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 23.0 m-30 -75.03 -54.52 7.02 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.755 -0.778 . . . . 0.62 110.125 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -64.69 -31.3 72.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 2.5800000000000001 111.777 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 15.7 m -84.9 0.19 51.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.794 0.33 . . . . 1.3200000000000001 111.471 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.97 79.06 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.774 -0.727 . . . . 1.0900000000000001 112.648 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -69.43 -47.33 64.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.94 0.4 . . . . 1.98 110.102 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.95 -30.49 61.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.149 -0.478 . . . . 0.34000000000000002 110.589 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.541 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -58.58 -39.55 80.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.51000000000000001 111.725 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -79.87 -29.54 40.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.78 -0.368 . . . . 2.8199999999999998 110.8 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 111' ' ' LYS . 66.7 t80 -66.56 -33.01 74.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.177 0.513 . . . . 0.48999999999999999 109.656 172.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.517 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -67.74 -25.59 65.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.349 -0.841 . . . . 0.58999999999999997 111.03 177.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.61 0 CA-C-N 115.558 -0.746 . . . . 1.6200000000000001 112.013 -179.989 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 p90 . . . . . 0 C--O 1.237 0.421 0 N-CA-C 109.821 -0.437 . . . . 1.47 109.821 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -105.7 149.45 26.37 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.968 -0.382 . . . . 3.1499999999999999 109.968 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -54.47 -45.55 73.2 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.921 0.391 . . . . 2.3500000000000001 111.233 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.54 16.34 1.39 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.477 0.547 . . . . 4.1600000000000001 112.477 -176.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -86.12 -8.56 57.78 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.647 -0.872 . . . . 2.5699999999999998 108.647 171.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.8 mt -85.62 129.27 55.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.947 -1.024 . . . . 0.68999999999999995 109.0 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -42.34 114.77 0.42 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.311 2.674 . . . . 0.59999999999999998 112.442 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.61 -23.96 65.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.82 -0.627 . . . . 0.56999999999999995 111.928 -174.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.32 -35.94 82.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.724 0.773 . . . . 1.3700000000000001 110.022 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -82.16 -20.24 38.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.655 -1.157 . . . . 0.80000000000000004 110.945 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -72.35 -20.24 61.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.266 -0.642 . . . . 1.73 109.266 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.4 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 6.4 t70 -74.71 -23.69 58.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.844 -1.071 . . . . 1.02 109.745 174.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.42 HD11 ' HG2' ' A' ' 147' ' ' LYS . 10.0 mp -83.6 -44.28 14.76 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 114.998 -1.001 . . . . 0.93000000000000005 110.33 173.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.505 ' SD ' ' HE3' ' A' ' 96' ' ' LYS . 46.4 ttp -68.14 128.7 93.22 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.111 -0.949 . . . . 1.1499999999999999 111.443 -173.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -64.89 149.61 89.3 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.142 2.561 . . . . 0.90000000000000002 112.808 -175.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 71.9 Cg_exo -51.89 -27.95 29.58 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.096 3.197 . . . . 0.95999999999999996 113.04 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -64.48 -57.42 9.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.26 0.553 . . . . 1.8300000000000001 109.584 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 -28.33 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.797 -0.638 . . . . 0.81999999999999995 110.577 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -68.89 -40.72 79.03 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.8 -0.636 . . . . 2.1600000000000001 110.758 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.67 -53.1 60.7 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.378 0.511 . . . . 1.0600000000000001 112.378 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 69.1 t80 -57.21 -41.78 80.1 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.458 0.54 . . . . 0.65000000000000002 112.458 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 25' ' ' LEU . 91.6 mt -88.85 -13.79 38.41 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 118.955 0.798 . . . . 1.1299999999999999 111.402 177.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -65.45 -42.39 92.4 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.241 -0.652 . . . . 2.0600000000000001 109.241 164.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -68.1 -53.24 26.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.331 -0.849 . . . . 1.8400000000000001 111.26 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.448 HD22 ' CB ' ' A' ' 29' ' ' ASP . 14.0 mt -56.17 129.91 42.08 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.545 0.688 . . . . 1.05 111.12 -177.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 m -143.47 -83.43 0.16 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.797 -1.092 . . . . 1.78 110.926 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.4 142.87 44.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.522 -0.308 . . . . 2.3900000000000001 110.651 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.81 -45.1 3.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.946 -0.645 . . . . 0.93000000000000005 112.959 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.561 ' O ' HG12 ' A' ' 32' ' ' VAL . 5.2 m-20 -57.02 -47.32 81.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 2.25 110.696 -177.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 mmtm -57.08 -31.21 65.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.833 -0.621 . . . . 1.3100000000000001 111.35 -174.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -67.8 -32.05 72.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.585 . . . . 0.80000000000000004 111.473 -178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 29' ' ' ASP . 4.7 p -95.18 -28.05 4.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.048 -0.523 . . . . 0.84999999999999998 111.722 -172.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.464 HD12 ' HE2' ' A' ' 37' ' ' PHE . 4.0 mm? -55.8 -45.95 78.13 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.707 0.262 . . . . 0.97999999999999998 111.707 175.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -62.15 -30.44 71.05 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.66 0.266 . . . . 2.4100000000000001 111.303 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -69.51 -37.06 77.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.331 -0.395 . . . . 1.96 110.611 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 86.8 t -71.97 -51.88 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.5 0.666 . . . . 0.97999999999999998 110.233 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.675 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 24.0 m-85 -59.93 -41.47 91.84 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.068 1.507 . . . . 0.82999999999999996 115.068 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -80.25 2.18 25.53 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.628 -0.829 . . . . 2.1800000000000002 111.293 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -98.07 -80.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.708 -0.678 . . . . 1.5600000000000001 109.623 172.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.44 -157.98 0.63 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.761 -0.733 . . . . 1.54 112.96 -172.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -93.88 153.29 14.77 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.042 -1.232 . . . . 1.6799999999999999 111.49 -7.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 25.7 m-85 -117.41 132.22 56.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.032 -0.531 . . . . 1.28 110.864 -173.043 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 22.2 pttp -87.91 -12.71 43.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.481 -0.781 . . . . 3.5099999999999998 109.907 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.552 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -159.84 151.79 20.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.617 -0.719 . . . . 1.52 109.532 -179.308 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.8 m -60.1 -22.02 62.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.615 . . . . 1.1799999999999999 112.037 -174.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.02 -40.24 80.33 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.816 0.341 . . . . 2.2400000000000002 110.801 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.3 mt-10 -64.77 -31.51 72.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 2.2599999999999998 111.086 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.3 t -75.61 -37.63 59.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 1.1899999999999999 109.831 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.11 -42.89 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.55000000000000004 109.655 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.06 -49.28 76.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.047 -0.979 . . . . 0.56999999999999995 111.361 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.85 95.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.848 -0.614 . . . . 0.5 110.669 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.28 -35.41 76.02 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 115.443 -0.799 . . . . 0.45000000000000001 111.43 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -65.39 -36.61 84.48 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.028 0.442 . . . . 1.22 110.814 175.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -66.75 -50.15 63.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 3.0499999999999998 110.363 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HB3' HG21 ' A' ' 32' ' ' VAL . 43.0 mmtt -66.55 -55.34 15.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 1.48 111.915 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.6 t -139.92 95.47 8.62 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 110.199 -0.297 . . . . 1.1599999999999999 110.199 -175.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.16 -58.94 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.922 3.081 . . . . 0.57999999999999996 113.424 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.35 -29.49 70.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.231 -0.895 . . . . 2.4500000000000002 112.064 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.83 -40.6 68.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.28 -1.007 . . . . 1.4199999999999999 108.28 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.99 -31.39 78.42 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.37 111.683 175.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.12 -43.08 68.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.28 -0.267 . . . . 0.47999999999999998 110.28 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -58.68 -45.16 90.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.255 -0.43 . . . . 2.1699999999999999 111.323 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.41 -33.3 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.284 . . . . 1.1200000000000001 111.121 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.03 -52.72 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.657 -0.247 . . . . 1.7 111.152 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -59.52 -36.49 76.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.43 0.633 . . . . 3.96 110.153 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.461 ' C ' HD13 ' A' ' 66' ' ' LEU . 2.4 tm? -66.44 -45.95 78.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.896 -1.047 . . . . 1.5 110.461 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -77.0 -27.62 54.73 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.357 -0.609 . . . . 2.3399999999999999 109.357 -171.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.91 96.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.223 -0.899 . . . . 0.40000000000000002 111.461 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 49.6 mtm -59.37 -51.3 70.49 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.712 0.768 . . . . 0.71999999999999997 109.32 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.6 t -52.41 -48.32 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 CA-C-N 114.121 -1.4 . . . . 0.79000000000000004 110.474 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 9.5 mmmm -61.6 -41.15 97.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.422 -0.808 . . . . 1.47 111.814 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 t -58.7 -40.68 84.32 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.093 0.473 . . . . 1.26 110.787 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.8 mttm -74.01 -41.69 61.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.905 -0.588 . . . . 1.54 110.691 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.457 HD11 HD12 ' A' ' 89' ' ' ILE . 64.2 mt -68.2 -24.5 30.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.379 0.609 . . . . 0.34000000000000002 110.662 177.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -39.66 71.56 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.667 -0.697 . . . . 0.34999999999999998 109.969 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.83 -46.52 62.58 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.939 -1.028 . . . . 0.48999999999999999 109.973 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 135' ' ' GLN . 7.1 tp -40.62 132.68 2.12 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 114.858 -1.064 . . . . 0.70999999999999996 112.723 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 159.71 49.34 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.562 -0.745 . . . . 0.76000000000000001 112.306 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -46.83 -41.12 25.32 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.795 2.997 . . . . 1.5600000000000001 113.722 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.4 -53.81 46.51 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.266 0.555 . . . . 2.52 110.393 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.553 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -78.02 -29.13 49.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.731 -0.668 . . . . 0.35999999999999999 111.099 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 25.8 ttpp -58.01 -42.52 85.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.722 -0.672 . . . . 2.04 110.53 176.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.35 -42.53 98.9 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.732 -0.747 . . . . 0.40999999999999998 111.676 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.458 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.6 t80 -65.94 -46.06 79.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.445 0.164 . . . . 1.6499999999999999 110.962 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.019 0.437 . . . . 0.40999999999999998 111.363 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.93 -23.37 65.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 1.96 111.209 -176.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -85.93 -49.81 7.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.448 -0.342 . . . . 2.1200000000000001 110.942 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.3 p -62.21 -40.71 97.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.327 -0.397 . . . . 0.56999999999999995 111.272 -176.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.457 HD12 HD11 ' A' ' 74' ' ' ILE . 43.5 mt -62.11 -37.15 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 116.172 -0.467 . . . . 1.0900000000000001 111.322 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -69.59 -36.71 76.48 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.768 -0.373 . . . . 2.8199999999999998 110.717 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.11 -48.85 86.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.325 0.584 . . . . 0.51000000000000001 109.801 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.8 68.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.592 -0.731 . . . . 0.64000000000000001 111.1 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.2 -41.41 99.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 4.4199999999999999 110.133 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -67.45 -32.45 79.17 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.059 -0.591 . . . . 0.66000000000000003 112.409 -177.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mm -61.13 -43.32 96.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.0 0.429 . . . . 0.55000000000000004 110.911 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.505 ' HE3' ' SD ' ' A' ' 14' ' ' MET . 3.5 mppt? -100.57 15.79 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.002 0.43 . . . . 2.7000000000000002 110.529 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.675 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -93.34 -31.1 14.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.661 -0.699 . . . . 0.63 109.22 168.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.579 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 14.4 ptm180 -86.36 -1.49 57.58 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.842 -0.617 . . . . 3.1000000000000001 109.941 173.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -81.16 -26.76 35.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.037 -0.727 . . . . 0.96999999999999997 109.037 164.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.596 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 24.0 m-85 -75.18 -48.89 21.37 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.404 0.621 . . . . 1.48 110.353 177.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 26.7 p -67.43 -15.6 63.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 0.87 112.906 -173.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.12 32.84 10.13 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.821 -0.704 . . . . 1.1599999999999999 112.401 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.66 61.71 1.4 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.705 -0.48 . . . . 1.8300000000000001 109.705 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.533 ' H ' ' CD ' ' A' ' 104' ' ' GLU . 4.8 mp0 -45.5 119.67 4.53 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-N 115.205 -0.907 . . . . 1.75 111.999 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 35.8 Cg_endo -67.7 153.63 75.47 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.57 2.18 . . . . 0.53000000000000003 111.629 175.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 108' ' ' ASP . 9.1 t -93.35 175.71 6.66 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.564 -0.902 . . . . 1.48 108.564 173.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 31.5 mtmt -62.71 -33.8 75.85 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.487 -0.485 . . . . 2.8799999999999999 110.199 -175.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.432 ' H ' HG23 ' A' ' 106' ' ' THR . 3.4 m-20 -58.95 -38.65 79.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.455 -0.793 . . . . 2.2400000000000002 111.197 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASP . . . . . 0.402 ' OD2' HG22 ' A' ' 106' ' ' THR . 37.1 m-20 -61.23 -44.16 97.71 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.023 -0.362 . . . . 1.73 110.023 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -67.59 -42.66 82.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.753 -0.658 . . . . 0.81999999999999995 110.749 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.9 mtpm? -55.61 -48.19 75.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.258 0.551 . . . . 1.74 110.325 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.48 93.06 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.31 -0.859 . . . . 0.46999999999999997 111.412 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 79.5 p -64.79 -38.38 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.172 0.434 . . . . 1.3400000000000001 112.172 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 152' ' ' ALA . 13.7 m -77.6 -23.65 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.847 0.832 . . . . 0.65000000000000002 109.362 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -63.96 -41.14 97.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.778 -1.101 . . . . 1.72 110.987 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.44 ' O ' HD13 ' A' ' 120' ' ' LEU . 18.1 mm-40 -72.32 -33.71 67.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.583 -0.447 . . . . 2.27 110.608 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.2 m -68.44 -34.41 65.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.546 -0.462 . . . . 0.81000000000000005 110.676 177.093 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 114' ' ' VAL . 3.1 mm? -70.7 -33.24 70.68 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.926 -0.484 . . . . 1.21 109.963 173.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.4 ttpt -60.71 -46.02 91.97 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.146 -0.687 . . . . 0.94999999999999996 109.146 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.93 -47.82 60.89 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.963 -1.017 . . . . 1.0600000000000001 111.804 175.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.458 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 70.3 t80 -70.18 -35.82 74.23 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.872 -0.731 . . . . 1.54 111.745 -167.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HE3' HD12 ' A' ' 118' ' ' LEU . 75.4 mttt -67.59 -27.32 66.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.884 0.373 . . . . 1.98 111.088 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.96 -7.58 58.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.944 -0.571 . . . . 0.69999999999999996 112.43 -176.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 41.2 mtm -75.68 159.25 31.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.433 -0.507 . . . . 0.5 111.047 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 m -63.43 143.33 57.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.359 -0.382 . . . . 1.1799999999999999 110.66 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -56.32 -46.23 79.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.607 0.241 . . . . 2.21 111.425 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.51 74.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.004 0.431 . . . . 0.41999999999999998 110.949 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.77 -35.77 58.43 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.683 -0.69 . . . . 0.31 111.761 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -66.71 -42.18 86.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.345 0.593 . . . . 1.3200000000000001 110.071 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.55 -29.88 68.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 0.41999999999999998 110.687 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -76.19 -32.33 58.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.227 0.537 . . . . 0.55000000000000004 109.785 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.6 -30.91 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.39000000000000001 109.698 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' A' ' 137' ' ' PRO . . . -75.7 0.69 60.59 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.759 -0.655 . . . . 0.27000000000000002 112.724 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -99.07 -28.99 13.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.581 0.705 . . . . 2.4300000000000002 109.584 175.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 50.4 mm-40 -97.95 -42.28 7.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.136 -0.938 . . . . 1.8300000000000001 110.147 -176.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -135.22 70.59 68.65 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.162 -0.472 . . . . 0.68999999999999995 110.11 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 133' ' ' GLY . 36.8 Cg_endo -65.88 -19.84 58.39 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.864 2.376 . . . . 0.63 112.632 -176.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 23.1 t80 -65.86 -37.82 87.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.378 -0.374 . . . . 2.3100000000000001 110.564 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.604 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -78.46 -44.71 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.905 -0.405 . . . . 1.02 109.905 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.15 -32.66 66.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.456 0.646 . . . . 0.34999999999999998 109.961 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.5 tttt -54.5 -74.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.563 -1.199 . . . . 2.5800000000000001 111.155 170.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.97 -28.21 43.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 112.944 0.72 . . . . 0.5 112.944 -173.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.604 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 19.7 m-30 -66.32 -55.28 16.73 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.517 -0.473 . . . . 0.62 110.139 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.9 -27.89 60.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.325 -0.852 . . . . 2.5800000000000001 111.383 -175.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 35.6 t -63.89 -26.95 68.83 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.531 -0.544 . . . . 1.3200000000000001 109.531 174.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 104.47 -5.02 44.02 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.818 -0.706 . . . . 1.0900000000000001 112.557 177.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.42 ' HG2' HD11 ' A' ' 13' ' ' LEU . 51.7 tttp -62.74 -56.33 18.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.789 0.328 . . . . 1.98 111.084 -176.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 13' ' ' LEU . . . -62.79 -36.49 83.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.34000000000000002 110.632 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -57.0 -51.26 69.97 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.51000000000000001 110.668 175.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 73.0 mmtt -59.95 -42.71 94.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.369 -0.378 . . . . 2.8199999999999998 111.007 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -59.95 -35.16 74.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.437 0.637 . . . . 0.48999999999999999 110.043 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.34 -7.99 56.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.565 -0.743 . . . . 0.58999999999999997 111.891 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.191 0 C-N-CA 120.895 -0.669 . . . . 1.6200000000000001 111.771 -176.264 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.821 ' CE1' ' HD3' ' A' ' 30' ' ' LYS . 2.2 p90 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-O 121.293 0.568 . . . . 1.47 109.628 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.431 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 3.3 mmmp? -117.62 -173.43 2.42 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 3.1499999999999999 109.818 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.508 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 77.5 t80 -69.62 -38.95 77.42 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.584 -0.895 . . . . 2.3500000000000001 108.584 173.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 1.7 mp0 -63.59 -26.21 68.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.487 -1.233 . . . . 4.1600000000000001 111.628 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -78.43 -17.83 55.82 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.898 0.38 . . . . 2.5699999999999998 110.969 -176.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.78 126.12 78.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 108.412 -0.959 . . . . 0.68999999999999995 108.412 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -42.12 114.05 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.328 2.685 . . . . 0.59999999999999998 113.041 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.43 -25.73 62.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.479 -0.782 . . . . 0.56999999999999995 111.792 -176.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -62.27 -38.73 90.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 122.043 0.925 . . . . 1.3700000000000001 109.677 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -80.94 -33.8 33.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.117 -1.401 . . . . 0.80000000000000004 111.238 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -66.48 -22.62 66.19 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.509 0.671 . . . . 1.73 109.235 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -72.85 -10.34 59.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.485 -1.234 . . . . 1.02 111.631 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -100.64 -42.33 6.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.689 0.281 . . . . 0.93000000000000005 111.55 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.466 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 25.9 ptt? -76.03 144.2 75.26 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.988 0.423 . . . . 1.1499999999999999 110.962 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.35 156.05 55.12 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.133 2.555 . . . . 0.90000000000000002 113.623 -172.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -42.41 -47.57 7.28 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.735 2.957 . . . . 0.95999999999999996 114.262 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.559 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.6 pm0 -56.56 -45.41 81.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.788 0.267 . . . . 1.8300000000000001 111.687 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.37 -16.04 62.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.191 0.52 . . . . 0.81999999999999995 110.992 -178.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.466 ' HD2' ' O ' ' A' ' 14' ' ' MET . 32.0 mtp180 -90.98 -32.31 16.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.795 -0.639 . . . . 2.1600000000000001 110.076 177.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 18.0 t70 -56.26 -49.32 74.54 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.67 -0.696 . . . . 1.0600000000000001 111.86 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.575 ' O ' HD23 ' A' ' 25' ' ' LEU . 60.1 t80 -54.45 -57.54 10.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.43 -0.35 . . . . 0.65000000000000002 111.349 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.612 HD21 ' OH ' ' A' ' 100' ' ' TYR . 88.6 mt -78.08 -6.69 55.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 119.06 0.846 . . . . 1.1299999999999999 112.062 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 29.9 tt0 -68.66 -34.67 76.09 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.009 0.433 . . . . 2.0600000000000001 110.077 163.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -77.93 -54.48 6.26 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.176 -0.466 . . . . 1.8400000000000001 110.954 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.575 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.3 mm? -55.27 132.02 46.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 1.05 110.488 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.5 m -137.37 -88.0 0.28 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 120.507 -0.477 . . . . 1.78 112.206 -172.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -132.58 119.41 20.45 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.898 0.38 . . . . 2.3900000000000001 111.096 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.62 -46.94 1.07 Allowed Glycine 0 CA--C 1.542 1.765 0 N-CA-C 115.459 0.944 . . . . 0.93000000000000005 115.459 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.571 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -95.2 -6.84 40.72 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.206 1.558 . . . . 2.25 115.206 -170.822 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.821 ' HD3' ' CE1' ' A' ' 1' ' ' PHE . 90.7 mttt -80.59 -15.89 55.49 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.024 -1.102 . . . . 1.3100000000000001 108.024 171.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -61.2 -31.59 71.36 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.567 -1.197 . . . . 0.80000000000000004 110.235 175.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.571 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.5 p -89.95 -23.98 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 115.983 -0.553 . . . . 0.84999999999999998 110.594 -178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.54 HD13 HD21 ' A' ' 52' ' ' LEU . 3.7 mm? -54.3 -52.41 61.57 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.194 0.198 . . . . 0.97999999999999998 111.065 170.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -62.11 -29.59 70.44 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.681 0.277 . . . . 2.4100000000000001 111.235 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.69 -41.89 99.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.04 -0.527 . . . . 1.96 110.348 175.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.622 HG12 ' OH ' ' A' ' 42' ' ' TYR . 63.7 t -68.42 -49.68 63.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.295 0.569 . . . . 0.97999999999999998 110.147 177.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.67 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.0 m-85 -55.4 -49.32 72.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 114.138 1.162 . . . . 0.82999999999999996 114.138 177.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -77.38 -5.46 49.77 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.937 -0.705 . . . . 2.1800000000000002 111.262 -174.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -90.02 -76.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.942 -0.572 . . . . 1.5600000000000001 109.559 169.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.63 -155.34 1.55 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.299 -0.476 . . . . 1.54 112.881 -175.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -98.49 154.65 7.43 Favored 'Cis proline' 0 N--CA 1.454 -0.826 0 CA-C-N 118.472 1.136 . . . . 1.6799999999999999 111.938 -7.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.622 ' OH ' HG12 ' A' ' 36' ' ' VAL . 1.0 OUTLIER -104.8 124.78 50.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.176 0.513 . . . . 1.28 110.71 -175.626 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -89.79 -13.62 36.28 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.684 -0.858 . . . . 3.5099999999999998 108.684 171.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.1 p30 -148.69 149.87 32.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.831 -1.077 . . . . 1.52 108.51 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 t -70.31 -16.28 62.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.004 0.431 . . . . 1.1799999999999999 110.887 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.606 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 32.3 tt0 -60.13 -36.73 78.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.933 -0.576 . . . . 2.2400000000000002 110.267 175.117 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -60.88 -38.85 87.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.212 -0.449 . . . . 2.2599999999999998 111.051 177.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.5 t -64.97 -41.7 95.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.229 -0.442 . . . . 1.1899999999999999 110.11 178.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.499 HD11 ' ND1' ' A' ' 67' ' ' HIS . 78.0 mt -66.28 -48.4 81.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.192 -0.458 . . . . 0.55000000000000004 110.641 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.53 76.44 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.577 -0.738 . . . . 0.56999999999999995 111.899 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.83 -38.64 82.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.171 0.51 . . . . 0.5 110.738 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.54 HD21 HD13 ' A' ' 33' ' ' LEU . 20.2 mt -72.6 -33.46 66.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.669 -0.696 . . . . 0.45000000000000001 111.462 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -66.29 -26.38 67.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.031 0.443 . . . . 1.22 110.833 175.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -77.44 -50.21 13.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.759 -0.655 . . . . 3.0499999999999998 110.532 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 32' ' ' VAL . 33.7 mmtt -65.38 -59.87 3.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.601 -0.727 . . . . 1.48 111.981 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.6 t -138.51 99.41 8.66 Favored Pre-proline 0 C--N 1.316 -0.869 0 C-N-CA 120.472 -0.491 . . . . 1.1599999999999999 110.811 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -40.3 -57.95 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.944 3.096 . . . . 0.57999999999999996 113.176 -172.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -56.59 -35.61 68.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.49 -1.232 . . . . 2.4500000000000002 111.933 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.419 HD11 ' HB3' ' A' ' 29' ' ' ASP . 53.9 mt -76.11 -41.32 50.61 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 119.575 -0.85 . . . . 1.4199999999999999 109.23 -174.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.446 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -61.58 -35.14 90.68 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.42 -1.263 . . . . 0.37 111.801 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.6 68.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.92 0.39 . . . . 0.47999999999999998 110.425 174.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 2.7 tppt? -67.22 -47.4 70.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.948 -0.569 . . . . 2.1699999999999999 110.768 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.478 HG23 HH21 ' A' ' 93' ' ' ARG . 13.4 p -69.65 -26.7 31.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.182 0.515 . . . . 1.1200000000000001 110.376 176.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -64.56 -52.98 54.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.63 -0.714 . . . . 1.7 110.954 176.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 66' ' ' LEU . 45.3 pttt -65.7 -30.59 71.3 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.727 -0.842 . . . . 3.96 108.727 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.95 -0.03 12.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 114.391 -1.277 . . . . 1.5 110.389 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.499 ' ND1' HD11 ' A' ' 49' ' ' ILE . 13.5 m80 -113.64 -48.25 2.94 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 115.843 -0.617 . . . . 2.3399999999999999 110.201 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.55 76.85 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.173 0.434 . . . . 0.40000000000000002 112.173 -178.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 44.0 mtm -66.63 -47.7 71.76 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.239 0.542 . . . . 0.71999999999999997 110.433 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.466 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 93.8 t -62.31 -41.85 93.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.424 -0.807 . . . . 0.79000000000000004 110.161 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 8.0 mmmm -63.26 -30.78 71.85 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 115.157 -0.929 . . . . 1.47 111.417 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 40.7 t -62.37 -43.31 99.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.289 0.566 . . . . 1.26 110.553 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -69.54 -39.02 77.7 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.343 -0.614 . . . . 1.54 109.343 177.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.536 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 75.1 mt -77.16 -14.37 14.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.652 0.739 . . . . 0.34000000000000002 111.148 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.74 -34.32 27.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.831 0.824 . . . . 0.34999999999999998 109.325 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.65 -0.68 57.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.972 -1.467 . . . . 0.48999999999999999 110.084 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.417 HD12 ' OD2' ' A' ' 131' ' ' ASP . 13.6 tp -91.4 138.39 31.62 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.462 -0.79 . . . . 0.70999999999999996 109.827 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.08 151.23 27.18 Favored Glycine 0 C--O 1.227 -0.3 0 CA-C-N 115.928 -0.578 . . . . 0.76000000000000001 112.537 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -43.52 -42.72 11.05 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.921 3.081 . . . . 1.5600000000000001 114.179 -176.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' H ' ' CD ' ' A' ' 80' ' ' GLU . 0.3 OUTLIER -81.02 -41.89 21.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.592 -0.276 . . . . 2.52 111.417 -177.085 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.22 82.3 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.568 0.699 . . . . 0.35999999999999999 109.935 178.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.536 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 28.6 ttpp -53.54 -48.22 69.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.596 -1.184 . . . . 2.04 111.389 174.209 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.7 -39.69 91.6 Favored Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.798 -0.715 . . . . 0.40999999999999998 112.191 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -67.34 -46.63 72.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.643 0.258 . . . . 1.6499999999999999 110.869 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.01 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.088 0.471 . . . . 0.40999999999999998 111.413 -177.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 41.2 mt-10 -65.71 -23.94 66.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.768 -0.651 . . . . 1.96 111.492 -176.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -93.98 -42.72 8.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 116.736 -0.211 . . . . 2.1200000000000001 111.359 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.3 p -60.38 -45.08 94.8 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.737 0.304 . . . . 0.56999999999999995 111.037 -177.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.592 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 1.7 mp -56.49 -40.13 66.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 1.0900000000000001 110.481 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -74.74 -35.08 62.63 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.121 0.415 . . . . 2.8199999999999998 112.121 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.537 HG22 ' OG ' ' A' ' 113' ' ' SER . 65.4 mt -63.84 -48.26 87.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.034 0.445 . . . . 0.51000000000000001 109.834 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.7 -30.03 70.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.699 -0.682 . . . . 0.64000000000000001 110.712 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.592 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 11.5 ttt85 -70.49 -40.58 73.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.302 -0.863 . . . . 4.4199999999999999 110.67 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.71 -32.29 83.67 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 121.255 -0.498 . . . . 0.66000000000000003 112.328 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.7 mm -62.63 -44.53 99.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.275 0.559 . . . . 0.55000000000000004 110.715 177.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 36.7 mtmm -91.74 8.85 35.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.903 -0.59 . . . . 2.7000000000000002 110.275 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.67 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -97.02 -33.15 11.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.781 -0.645 . . . . 0.63 109.61 171.12 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.418 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 13.8 ptp180 -83.51 -3.34 57.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.161 -0.681 . . . . 3.1000000000000001 109.161 172.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.492 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.112 -0.699 . . . . 0.96999999999999997 109.112 164.345 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' HD21 ' A' ' 22' ' ' LEU . 26.9 m-85 -70.17 -48.53 56.87 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.033 -0.53 . . . . 1.48 110.97 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.5 p -62.15 -19.97 63.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.289 -0.869 . . . . 0.87 112.722 -173.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.39 1.72 40.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.695 -0.764 . . . . 1.1599999999999999 112.208 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -101.41 60.32 0.9 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.648 -0.501 . . . . 1.8300000000000001 109.648 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 48.4 mt-10 -50.77 116.11 6.64 Favored Pre-proline 0 C--O 1.234 0.251 0 O-C-N 123.817 0.698 . . . . 1.75 111.691 -173.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 31.6 Cg_endo -64.57 157.16 56.81 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 123.49 2.793 . . . . 0.53000000000000003 113.324 -174.415 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.416 ' O ' HD13 ' A' ' 110' ' ' LEU . 75.3 p -87.86 178.0 6.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.524 -0.307 . . . . 1.48 110.31 174.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.64 -25.49 65.76 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.126 0.489 . . . . 2.8799999999999999 109.972 175.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.469 ' HA ' ' HG2' ' A' ' 111' ' ' LYS . 23.3 m-20 -71.11 -30.84 67.03 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.917 -0.583 . . . . 2.2400000000000002 110.541 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.15 -46.48 80.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.19 0.519 . . . . 1.73 109.802 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' THR . 10.2 mp -64.91 -47.89 76.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.601 -0.727 . . . . 0.81999999999999995 111.691 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 108' ' ' ASP . 16.0 ptpt -60.89 -38.5 85.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.912 0.387 . . . . 1.74 110.283 -177.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.21 75.27 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.926 -0.579 . . . . 0.46999999999999997 111.229 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.537 ' OG ' HG22 ' A' ' 91' ' ' ILE . 24.7 t -55.33 -48.01 74.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.986 -0.552 . . . . 1.3400000000000001 110.925 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.619 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.6 m -77.29 -28.04 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.547 0.689 . . . . 0.65000000000000002 109.534 -176.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 22.2 ttmm -59.11 -44.82 92.01 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.208 -0.905 . . . . 1.72 111.675 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.485 ' O ' HD13 ' A' ' 120' ' ' LEU . 20.3 mt-10 -71.14 -34.32 70.9 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.026 -0.67 . . . . 2.27 111.253 -176.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.1 m -68.89 -22.41 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 C-N-CA 120.365 -0.534 . . . . 0.81000000000000005 109.728 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 149' ' ' ALA . 22.0 mt -83.44 -36.82 23.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.483 -0.326 . . . . 1.21 110.485 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.62 -39.53 80.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.615 0.722 . . . . 0.94999999999999996 109.293 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -73.11 -48.74 33.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.896 -1.047 . . . . 1.0600000000000001 112.165 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.626 ' CE2' ' HB3' ' A' ' 143' ' ' PHE . 0.0 OUTLIER -70.59 -35.52 73.07 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 119.011 -1.075 . . . . 1.54 111.234 -168.953 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -61.72 -33.12 73.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.006 0.431 . . . . 1.98 110.59 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.09 -1.7 57.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.69999999999999996 112.464 -176.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.577 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 50.8 mtm -74.82 157.81 34.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.333 -0.547 . . . . 0.5 111.076 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.5 m -63.21 149.08 46.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.148 -0.478 . . . . 1.1799999999999999 110.368 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -59.34 -43.28 92.78 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.543 0.211 . . . . 2.21 111.534 -174.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.41 -25.96 68.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.836 0.35 . . . . 0.41999999999999998 111.046 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.76 -36.79 31.85 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.801 -0.714 . . . . 0.31 111.608 177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.577 ' HE3' ' O ' ' A' ' 124' ' ' MET . 97.5 mttt -65.46 -45.57 83.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.449 0.643 . . . . 1.3200000000000001 110.014 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.31 -41.27 94.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.091 -0.958 . . . . 0.41999999999999998 111.652 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.417 ' OD2' HD12 ' A' ' 77' ' ' LEU . 38.7 t70 -71.55 -31.47 67.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.059 0.457 . . . . 0.55000000000000004 109.853 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -61.86 -29.09 69.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.865 -0.607 . . . . 0.39000000000000001 110.148 173.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . 0.411 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -72.73 -22.15 79.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.98 -0.629 . . . . 0.27000000000000002 112.737 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -81.87 -35.39 29.35 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.716 0.769 . . . . 2.4300000000000002 109.867 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 32.6 mm-40 -89.86 -36.88 14.82 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.521 -1.218 . . . . 1.8300000000000001 110.794 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.466 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 48.7 m-85 -130.21 79.27 73.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.022 0.439 . . . . 0.68999999999999995 110.408 175.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.98 -37.75 32.05 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 123.146 2.564 . . . . 0.63 113.141 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 41.6 t80 -69.3 -38.05 78.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.814 0.34 . . . . 2.3100000000000001 110.592 -175.092 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.3 mt -75.58 -44.02 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.02 110.956 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.411 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.76 -37.51 76.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.988 0.423 . . . . 0.34999999999999998 109.961 177.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 16.9 tppt? -48.1 -69.51 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.212 -0.903 . . . . 2.5800000000000001 111.532 171.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.8 m -63.57 -27.45 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 115.372 -0.831 . . . . 0.5 112.569 -174.031 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 22.7 m-30 -74.79 -54.12 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.065 -0.654 . . . . 0.62 110.263 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.79 -32.45 73.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 2.5800000000000001 111.941 -176.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.2 t -75.24 -7.9 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.511 -0.313 . . . . 1.3200000000000001 110.859 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.7 13.17 83.81 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.867 -0.683 . . . . 1.0900000000000001 111.774 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.37 -56.09 9.73 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.972 0.415 . . . . 1.98 110.525 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.82 70.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.952 -0.567 . . . . 0.34000000000000002 110.073 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -61.25 -36.82 81.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.46 -0.791 . . . . 0.51000000000000001 111.137 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.06 -32.76 61.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 2.8199999999999998 110.169 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -68.51 -31.33 70.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.92 -0.582 . . . . 0.48999999999999999 109.901 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.496 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.6 -15.85 62.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.961 -0.563 . . . . 0.58999999999999997 110.851 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.779 0 CA-C-N 115.839 -0.619 . . . . 1.6200000000000001 113.101 176.399 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.524 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 13.6 p90 . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.029 -0.73 . . . . 1.47 109.029 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.488 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 4.2 mmmp? -129.32 171.72 12.21 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.667 0.27 . . . . 3.1499999999999999 110.906 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.615 ' OH ' ' HD2' ' A' ' 19' ' ' ARG . 87.1 t80 -56.97 -41.32 78.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.508 0.67 . . . . 2.3500000000000001 109.89 175.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.488 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 2.1 mp0 -64.35 -24.5 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.809 -1.087 . . . . 4.1600000000000001 111.999 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -82.91 -14.67 53.75 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.561 -0.456 . . . . 2.5699999999999998 110.649 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.6 mt -82.18 128.9 66.03 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.222 -0.658 . . . . 0.68999999999999995 109.222 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -42.49 115.18 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.573 2.849 . . . . 0.59999999999999998 112.763 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -21.67 66.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.56999999999999995 112.112 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.35 -37.07 82.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.792 0.806 . . . . 1.3700000000000001 109.685 178.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -80.91 -28.76 35.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.396 -1.274 . . . . 0.80000000000000004 111.127 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 14.8 mtm180 -69.46 -21.28 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.723 -0.473 . . . . 1.73 109.723 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.467 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 13.3 t70 -65.68 -21.14 66.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.313 -0.858 . . . . 1.02 110.52 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.2 mt -89.41 -12.43 40.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.947 -0.57 . . . . 0.93000000000000005 110.937 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 68.1 mtm -95.35 129.2 35.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.029 0.442 . . . . 1.1499999999999999 110.531 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.474 ' HB2' ' OE1' ' A' ' 17' ' ' GLU . 38.3 Cg_endo -66.67 153.02 79.46 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.858 2.372 . . . . 0.90000000000000002 112.53 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -42.97 -47.14 8.51 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.384 2.723 . . . . 0.95999999999999996 113.882 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 15' ' ' PRO . 1.6 pm0 -60.81 -45.3 94.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.661 0.267 . . . . 1.8300000000000001 111.609 -178.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -28.46 69.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.81999999999999995 110.856 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.615 ' HD2' ' OH ' ' A' ' 3' ' ' TYR . 45.3 mtm105 -89.11 -29.03 19.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.924 -0.58 . . . . 2.1600000000000001 111.132 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 28.4 t70 -56.02 -38.84 71.07 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.419 0.628 . . . . 1.0600000000000001 111.134 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.606 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.2 t80 -57.71 -58.78 6.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.55 -0.75 . . . . 0.65000000000000002 110.985 174.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.468 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.0 mt -75.04 -7.82 54.78 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 119.456 1.026 . . . . 1.1299999999999999 111.941 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.462 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 6.3 tp60 -67.57 -41.63 83.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.247 0.546 . . . . 2.0600000000000001 110.187 162.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -73.8 -52.46 13.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.585 -0.734 . . . . 1.8400000000000001 110.838 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -50.61 121.36 5.69 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.632 1.206 . . . . 1.05 112.737 -177.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.711 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 15.6 m -141.17 -169.43 2.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 112.547 -2.115 . . . . 1.78 107.938 178.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -57.13 144.05 36.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 118.28 0.491 . . . . 2.3900000000000001 111.026 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.9 -58.18 0.63 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.799 -0.715 . . . . 0.93000000000000005 112.248 -178.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.653 ' O ' HG12 ' A' ' 32' ' ' VAL . 40.9 m-20 -87.12 -30.95 20.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.571 0.224 . . . . 2.25 111.29 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.711 ' HG3' ' O ' ' A' ' 26' ' ' SER . 3.0 mtpm? -69.75 -17.97 63.48 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.659 -0.651 . . . . 1.3100000000000001 110.072 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.434 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 9.9 m -64.75 -36.24 83.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.894 -1.048 . . . . 0.80000000000000004 110.823 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.661 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 12.2 p -81.99 -32.02 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 116.183 -0.462 . . . . 0.84999999999999998 112.147 -174.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.587 HD13 HD21 ' A' ' 52' ' ' LEU . 4.4 mm? -55.08 -42.74 73.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.348 . . . . 0.97999999999999998 110.062 175.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.42 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 3.7 ttpm? -63.29 -29.01 70.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.427 0.632 . . . . 2.4100000000000001 110.341 -178.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 31' ' ' THR . 9.8 mm-40 -79.26 -45.33 19.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.232 -0.895 . . . . 1.96 110.769 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 32' ' ' VAL . 12.0 m -75.79 -37.0 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 112.276 0.473 . . . . 0.97999999999999998 112.276 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -62.12 -43.97 97.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.812 1.042 . . . . 0.82999999999999996 113.812 171.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -80.51 -17.48 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.694 -0.803 . . . . 2.1800000000000002 110.57 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.58 -77.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 1.5600000000000001 109.904 168.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.78 -147.16 2.37 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 121.058 -0.591 . . . . 1.54 112.558 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -91.22 123.14 4.82 Favored 'Cis proline' 0 N--CA 1.457 -0.654 0 CA-C-N 118.747 1.274 . . . . 1.6799999999999999 110.541 -12.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 21.4 m-85 -99.04 116.95 32.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.55 0.69 . . . . 1.28 111.873 -169.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -71.02 -15.88 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.708 -1.133 . . . . 3.5099999999999998 111.422 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 46' ' ' GLU . 9.1 p30 -147.2 164.45 33.12 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.156 -0.313 . . . . 1.52 110.156 -174.106 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -73.18 -32.22 64.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 1.1799999999999999 111.918 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.435 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 50.1 mt-10 -58.36 -41.81 85.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.565 0.222 . . . . 2.2400000000000002 111.051 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.3 OUTLIER -61.98 -33.51 74.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.588 -0.278 . . . . 2.2599999999999998 111.529 176.629 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.4 m -71.69 -40.29 69.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.27 0.557 . . . . 1.1899999999999999 109.821 177.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.84 -44.86 98.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.34 -0.845 . . . . 0.55000000000000004 110.266 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.578 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -55.9 -49.24 73.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.368 -0.833 . . . . 0.56999999999999995 111.255 175.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB1' ' CG1' ' A' ' 36' ' ' VAL . . . -53.33 -41.6 65.89 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.987 -0.551 . . . . 0.5 111.017 178.423 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 33' ' ' LEU . 63.3 mt -70.54 -40.82 73.19 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.801 -0.636 . . . . 0.45000000000000001 111.199 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -62.89 -33.64 75.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.08 0.4 . . . . 1.22 112.08 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 33.4 mmtp -71.91 -28.44 63.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.393 -0.367 . . . . 3.0499999999999998 111.463 -177.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -99.02 -50.53 4.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.08 0.466 . . . . 1.48 110.818 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 t -127.42 93.67 40.2 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.697 -0.853 . . . . 1.1599999999999999 108.697 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.93 -53.31 7.28 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.798 2.998 . . . . 0.57999999999999996 112.63 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 17.1 tp10 -57.34 -37.68 72.94 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 114.481 -1.236 . . . . 2.4500000000000002 111.655 177.095 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 29' ' ' ASP . 1.6 tt -70.04 -45.78 66.42 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.246 -1.02 . . . . 1.4199999999999999 108.246 -174.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.417 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.88 -32.43 84.14 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 114.235 -1.348 . . . . 0.37 111.865 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.78 81.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.809 0.338 . . . . 0.47999999999999998 110.528 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 96.2 mttt -62.72 -53.02 60.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.087 -0.506 . . . . 2.1699999999999999 110.836 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.417 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.7 p -67.61 -28.71 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.489 -0.323 . . . . 1.1200000000000001 111.203 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -62.04 -60.02 4.22 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 110.096 -0.335 . . . . 1.7 110.096 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.647 ' O ' ' HG3' ' A' ' 69' ' ' MET . 70.8 mmtt -64.14 -36.64 84.69 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.298 0.57 . . . . 3.96 109.827 -176.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 21' ' ' PHE . 15.1 tp -63.24 -38.79 92.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.94 -1.027 . . . . 1.5 110.648 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -81.62 -33.34 31.53 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.746 -0.661 . . . . 2.3399999999999999 109.62 -175.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.69 -36.56 83.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.222 -0.899 . . . . 0.40000000000000002 111.185 177.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.647 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 26.6 mtm -63.38 -54.15 41.31 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.203 0.525 . . . . 0.71999999999999997 109.918 176.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.2 t -54.74 -40.77 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.296 -0.866 . . . . 0.79000000000000004 110.108 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.66 -40.73 92.76 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.77 -1.105 . . . . 1.47 111.207 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.3 m -57.57 -37.69 73.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 1.26 110.721 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.8 mttm -67.45 -46.69 72.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 1.54 110.31 176.594 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.88 -29.29 42.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.005 0.431 . . . . 0.34000000000000002 111.698 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.33 -37.47 85.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.487 0.66 . . . . 0.34999999999999998 109.956 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.61 -1.47 56.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.789 -1.096 . . . . 0.48999999999999999 111.152 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 132' ' ' PHE . 8.9 tp -92.85 134.99 34.54 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.169 -0.469 . . . . 0.70999999999999996 109.857 -176.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.63 149.83 51.58 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.599 -0.81 . . . . 0.76000000000000001 111.846 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -39.05 -36.33 0.7 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 124.381 3.387 . . . . 1.5600000000000001 114.452 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.88 -56.03 18.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.335 0.588 . . . . 2.52 109.68 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.94 -29.99 35.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.664 -0.698 . . . . 0.35999999999999999 110.807 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -61.74 -38.85 89.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.578 -0.737 . . . . 2.04 110.86 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.57 -40.24 95.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.584 -0.817 . . . . 0.40999999999999998 111.443 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 32.7 t80 -67.79 -49.88 59.96 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.837 -0.181 . . . . 1.6499999999999999 111.223 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.97 -51.89 59.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.945 0.403 . . . . 0.40999999999999998 112.004 -176.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -71.06 -27.7 63.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.335 -0.393 . . . . 1.96 111.359 -175.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.495 ' O ' ' HB3' ' A' ' 90' ' ' GLU . 58.7 tttp -84.08 -39.48 19.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.552 0.215 . . . . 2.1200000000000001 111.049 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 p -65.24 -46.09 82.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.795 0.331 . . . . 0.56999999999999995 110.228 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.84 -31.59 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.017 -0.538 . . . . 1.0900000000000001 110.339 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.495 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 9.3 tp10 -61.91 -47.56 84.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.884 0.374 . . . . 2.8199999999999998 110.269 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.465 HG22 ' OG ' ' A' ' 113' ' ' SER . 71.9 mt -63.09 -46.86 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.51000000000000001 110.398 178.035 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.413 ' O ' ' HD2' ' A' ' 96' ' ' LYS . . . -64.33 -35.97 82.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.827 -0.624 . . . . 0.64000000000000001 110.829 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.451 ' HA ' ' HD3' ' A' ' 96' ' ' LYS . 46.1 mtm180 -62.18 -41.46 98.35 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.795 -0.639 . . . . 4.4199999999999999 110.813 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.525 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -60.82 -33.94 85.08 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.768 -0.729 . . . . 0.66000000000000003 112.013 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.5 mm -64.0 -43.42 97.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.598 0.237 . . . . 0.55000000000000004 111.508 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.506 ' HB3' ' HZ2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -93.48 -9.47 38.31 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 119.916 -0.714 . . . . 2.7000000000000002 110.753 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.21 78.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.056 0.455 . . . . 0.63 109.891 170.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 12.1 ptm180 -85.23 3.43 39.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 3.1000000000000001 110.043 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.2 m-85 -90.42 -45.51 8.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.037 -0.727 . . . . 0.96999999999999997 109.037 162.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.524 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 35.2 m-85 -59.63 -34.25 72.55 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 1.48 111.785 -177.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.5 p -71.73 -2.66 18.26 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.404 0.52 . . . . 0.87 112.404 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 92.58 31.64 8.68 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.807 -0.711 . . . . 1.1599999999999999 112.304 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 44.7 m-80 -130.8 176.23 8.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.53 -0.545 . . . . 1.8300000000000001 109.53 -178.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 49.8 mt-10 -142.73 106.87 5.43 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 111.654 0.242 . . . . 1.75 111.654 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.4 Cg_endo -59.17 160.29 19.58 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.834 2.356 . . . . 0.53000000000000003 111.886 173.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 72.2 p -86.1 165.15 16.83 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.127 -0.694 . . . . 1.48 109.127 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 8.7 ptpp? -61.97 -23.72 66.56 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.334 -0.546 . . . . 2.8799999999999999 109.88 177.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.412 ' HA ' ' HD2' ' A' ' 111' ' ' LYS . 16.4 m-20 -72.27 -32.43 66.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.693 -0.685 . . . . 2.2400000000000002 110.937 178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -62.98 -41.29 99.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.421 0.629 . . . . 1.73 109.694 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.425 ' O ' HG13 ' A' ' 114' ' ' VAL . 7.5 mp -66.19 -41.07 90.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.229 -0.896 . . . . 0.81999999999999995 110.413 177.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 93.5 mttt -54.49 -52.72 61.04 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.959 0.409 . . . . 1.74 109.939 174.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -59.84 -43.34 94.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.611 -0.722 . . . . 0.46999999999999997 111.143 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.506 ' O ' HG13 ' A' ' 117' ' ' VAL . 44.2 t -55.93 -48.84 74.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 1.3400000000000001 111.667 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.774 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.0 m -80.95 -24.85 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.616 0.722 . . . . 0.65000000000000002 110.056 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 37.7 ttmt -66.63 -41.5 88.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 1.72 111.333 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.458 ' O ' HD13 ' A' ' 120' ' ' LEU . 12.7 mm-40 -71.87 -35.46 69.81 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.57 -0.452 . . . . 2.27 110.706 -178.613 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.37 -33.16 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.678 -0.409 . . . . 0.81000000000000005 110.251 176.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.559 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 85.1 mt -72.78 -34.85 67.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.038 -0.356 . . . . 1.21 110.038 176.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.01 -43.8 95.0 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.148 -0.686 . . . . 0.94999999999999996 109.148 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -69.83 -48.07 60.36 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.123 -0.944 . . . . 1.0600000000000001 111.498 174.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.623 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 37.9 t80 -69.61 -37.92 77.07 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.878 -0.729 . . . . 1.54 111.702 -168.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -61.07 -33.02 72.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.828 0.347 . . . . 1.98 111.097 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -87.36 -8.03 57.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.746 0.647 . . . . 0.69999999999999996 112.746 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -74.3 159.71 32.06 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.275 -0.57 . . . . 0.5 111.558 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -59.26 145.06 44.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.067 -0.515 . . . . 1.1799999999999999 110.494 173.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.91 -43.39 98.92 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.275 -0.42 . . . . 2.21 111.999 -174.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.4 -29.74 70.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.41999999999999998 110.656 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.99 -36.27 57.29 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.563 -0.744 . . . . 0.31 111.602 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.623 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 98.9 mttt -63.6 -45.98 87.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.336 0.588 . . . . 1.3200000000000001 110.061 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.32 74.56 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.443 -0.799 . . . . 0.41999999999999998 111.431 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -74.21 -31.95 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.601 -0.518 . . . . 0.55000000000000004 109.601 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.42 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.9 t80 -60.11 -34.22 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.699 -0.682 . . . . 0.39000000000000001 109.811 172.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.15 -10.42 78.2 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.27000000000000002 113.202 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -87.72 -29.34 21.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.351 0.596 . . . . 2.4300000000000002 110.268 177.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.5 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -100.98 -37.81 8.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.192 -0.913 . . . . 1.8300000000000001 111.046 -176.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -128.05 71.47 78.94 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.907 0.384 . . . . 0.68999999999999995 110.073 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -62.44 -36.66 64.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.045 2.496 . . . . 0.63 112.427 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.528 ' O ' HG13 ' A' ' 142' ' ' VAL . 61.7 t80 -64.31 -41.62 96.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.46 -0.336 . . . . 2.3100000000000001 110.344 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.445 HD21 ' HD3' ' A' ' 15' ' ' PRO . 94.9 mt -72.02 -44.68 63.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.486 -0.325 . . . . 1.02 110.333 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -57.19 -40.71 77.92 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.95 -0.389 . . . . 0.34999999999999998 109.95 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 22.6 ttpp -46.25 -71.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.323 -0.853 . . . . 2.5800000000000001 111.193 172.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.1 m -62.83 -26.51 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.658 -0.701 . . . . 0.5 112.259 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -74.51 -41.64 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.848 -0.741 . . . . 0.62 110.488 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 37.3 mt-10 -79.68 -31.71 41.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.747 0.308 . . . . 2.5800000000000001 111.073 -178.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 57.3 m -70.18 -10.76 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 1.3200000000000001 111.224 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 79.41 14.99 80.78 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.853 -0.689 . . . . 1.0900000000000001 111.547 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.467 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 54.8 tptt -69.49 -59.9 2.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.805 0.336 . . . . 1.98 110.585 -177.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.28 75.46 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.132 0.491 . . . . 0.34000000000000002 109.781 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.559 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -59.32 -45.61 90.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.342 -0.845 . . . . 0.51000000000000001 111.136 178.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -67.47 -39.81 85.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.317 -0.401 . . . . 2.8199999999999998 110.405 -178.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -59.81 -39.53 85.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.917 -0.583 . . . . 0.48999999999999999 110.537 176.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.774 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -73.2 -21.13 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.49 . . . . 0.58999999999999997 111.515 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.784 0 N-CA-C 110.447 -1.061 . . . . 1.6200000000000001 110.447 -171.746 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.2 p90 . . . . . 0 C--O 1.239 0.506 0 CA-C-O 121.103 0.478 . . . . 1.47 110.116 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 10.5 mtmp? -121.62 155.65 34.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.964 -0.562 . . . . 3.1499999999999999 109.676 177.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.733 ' CE1' ' HB3' ' A' ' 22' ' ' LEU . 47.6 m-85 -83.79 -0.16 49.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.07 0.938 . . . . 2.3500000000000001 109.592 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -84.16 -19.79 33.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.94 -1.482 . . . . 4.1600000000000001 108.881 170.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 9.8 m-20 -96.76 -14.58 21.87 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.88 -0.6 . . . . 2.5699999999999998 110.344 -174.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.08 130.69 71.74 Favored Pre-proline 0 N--CA 1.449 -0.491 0 N-CA-C 108.601 -0.889 . . . . 0.68999999999999995 108.601 176.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -40.5 106.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.342 2.694 . . . . 0.59999999999999998 112.533 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.79 -22.3 66.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.574 -0.739 . . . . 0.56999999999999995 111.474 -174.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -63.91 -29.26 70.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.918 0.866 . . . . 1.3700000000000001 109.559 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 40.4 t80 -91.8 -27.92 17.69 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.178 -1.374 . . . . 0.80000000000000004 110.723 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.411 ' HD2' ' SD ' ' A' ' 14' ' ' MET . 7.3 mmm180 -68.13 -23.8 64.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.336 0.589 . . . . 1.73 109.544 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.6 -30.12 71.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.989 -1.005 . . . . 1.02 110.587 173.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.581 HD22 HG21 ' A' ' 142' ' ' VAL . 13.6 mt -82.34 -14.94 54.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.961 -0.563 . . . . 0.93000000000000005 110.246 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.411 ' SD ' ' HD2' ' A' ' 11' ' ' ARG . 66.9 mtt -71.16 130.19 88.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 1.1499999999999999 110.616 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 23.7 Cg_exo -63.48 126.62 18.02 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.267 1.978 . . . . 0.90000000000000002 111.683 176.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -40.33 -48.78 4.06 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.963 3.109 . . . . 0.95999999999999996 114.571 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -75.99 -24.17 55.32 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.814 0.301 . . . . 1.8300000000000001 111.814 -175.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.34 54.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.265 -0.643 . . . . 0.81999999999999995 109.265 174.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -71.61 -29.71 64.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.221 -0.899 . . . . 2.1600000000000001 110.242 173.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -49.49 -53.72 21.67 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.849 0.718 . . . . 1.0600000000000001 110.798 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.542 ' O ' ' HB2' ' A' ' 24' ' ' ASN . 87.6 t80 -52.88 -62.11 1.86 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.054 -0.521 . . . . 0.65000000000000002 111.723 178.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.733 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 36.5 mt -69.25 -20.14 63.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 118.856 0.753 . . . . 1.1299999999999999 111.821 -177.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -64.7 -31.81 73.19 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 119.187 0.903 . . . . 2.0600000000000001 110.91 166.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 21' ' ' PHE . 0.9 OUTLIER -68.11 -47.65 67.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.073 -0.512 . . . . 1.8400000000000001 112.178 179.505 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.495 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.2 mm? -59.53 140.54 56.19 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.32 0.581 . . . . 1.05 111.177 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 t -122.53 -68.56 0.88 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.221 -0.9 . . . . 1.78 111.463 -174.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -151.13 -70.51 0.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.016 0.376 . . . . 2.3900000000000001 112.016 -174.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.36 -27.3 72.96 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.105 -0.569 . . . . 0.93000000000000005 112.687 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.1 p30 -73.84 -35.66 64.82 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.892 0.377 . . . . 2.25 110.843 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.95 -30.06 71.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.006 0.432 . . . . 1.3100000000000001 110.929 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 44.3 m -56.28 -43.86 79.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.656 -0.702 . . . . 0.80000000000000004 111.223 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.12 -28.55 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.957 -0.565 . . . . 0.84999999999999998 110.39 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -55.79 -46.72 77.9 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 121.119 0.485 . . . . 0.97999999999999998 109.799 168.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.486 ' HG2' ' HE3' ' A' ' 38' ' ' LYS . 37.2 ttmt -57.06 -29.92 63.83 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.326 -0.852 . . . . 2.4100000000000001 110.665 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -78.92 -34.18 44.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 1.96 111.232 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 78.4 t -71.29 -49.51 47.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.246 0.546 . . . . 0.97999999999999998 110.478 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.542 ' HE2' ' CD2' ' A' ' 100' ' ' TYR . 35.4 m-85 -57.43 -24.63 56.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.174 0.805 . . . . 0.82999999999999996 113.174 176.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE3' ' HG2' ' A' ' 34' ' ' LYS . 9.7 mtmp? -101.42 14.68 31.22 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.966 -0.694 . . . . 2.1800000000000002 110.911 176.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.86 23.33 10.75 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.086 -0.506 . . . . 1.5600000000000001 110.747 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.64 -149.86 9.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.88 -0.676 . . . . 1.54 111.852 174.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.0 162.94 86.45 Favored 'Cis proline' 0 N--CA 1.462 -0.346 0 CA-C-N 118.827 1.313 . . . . 1.6799999999999999 112.064 -2.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -119.01 134.06 55.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.955 -0.566 . . . . 1.28 110.217 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -91.39 -6.29 53.13 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.099 -0.955 . . . . 3.5099999999999998 109.981 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.406 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.7 p30 -156.15 149.99 25.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.619 -0.719 . . . . 1.52 109.607 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.2 m -61.6 -26.59 68.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.518 -0.765 . . . . 1.1799999999999999 111.45 -177.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.99 -33.2 75.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 2.2400000000000002 111.833 -177.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HG3' HD21 ' A' ' 44' ' ' ASN . 44.5 mt-10 -63.11 -35.33 79.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 2.2599999999999998 110.867 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.8 t -69.68 -35.77 75.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.646 -0.501 . . . . 1.1899999999999999 109.646 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 77.5 mt -66.58 -43.36 90.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.737 -0.665 . . . . 0.55000000000000004 110.108 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 -50.79 72.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.305 -0.861 . . . . 0.56999999999999995 111.148 176.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.77 82.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.5 110.773 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 33' ' ' LEU . 10.8 mt -68.59 -37.56 79.92 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.646 -0.706 . . . . 0.45000000000000001 111.376 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -61.56 -38.96 89.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.003 0.43 . . . . 1.22 110.825 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -69.54 -50.75 41.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 3.0499999999999998 110.811 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.586 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 12.5 mmtt -66.91 -43.81 82.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.8 -0.636 . . . . 1.48 112.32 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.2 m -149.86 97.17 3.47 Favored Pre-proline 0 C--N 1.315 -0.893 0 O-C-N 122.073 -0.392 . . . . 1.1599999999999999 110.485 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -40.82 -56.13 1.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.86 3.04 . . . . 0.57999999999999996 113.276 -171.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.57 -34.54 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.596 -1.184 . . . . 2.4500000000000002 112.208 -177.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 mt -71.71 -40.54 69.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.698 0.761 . . . . 1.4199999999999999 109.156 -176.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.631 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.54 -35.08 91.27 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.35 -1.296 . . . . 0.37 111.526 175.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -69.24 -42.31 75.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.64 0.257 . . . . 0.47999999999999998 110.34 174.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -55.37 -53.28 58.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.967 -0.561 . . . . 2.1699999999999999 110.981 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.1 -30.93 45.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 1.1200000000000001 111.15 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.631 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -62.24 -58.28 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.404 -0.362 . . . . 1.7 110.224 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.586 ' O ' ' HG3' ' A' ' 69' ' ' MET . 85.7 mttt -61.56 -38.79 88.8 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.388 0.614 . . . . 3.96 110.03 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -64.77 -39.47 93.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.062 -0.972 . . . . 1.5 109.82 -179.023 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.53 -29.24 46.34 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.77 -0.65 . . . . 2.3399999999999999 109.292 -175.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.19 -39.82 95.74 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.086 -0.961 . . . . 0.40000000000000002 111.321 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.586 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 20.2 mtm -64.93 -46.94 79.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.429 -0.582 . . . . 0.71999999999999997 109.429 177.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.499 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 94.1 t -56.71 -42.61 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 114.912 -1.04 . . . . 0.79000000000000004 110.289 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -64.17 -38.87 92.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.798 -0.637 . . . . 1.47 110.811 177.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -56.89 -33.3 66.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.196 0.522 . . . . 1.26 110.382 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 69' ' ' MET . 65.4 mmtt -79.38 -49.63 12.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.6 -0.727 . . . . 1.54 110.441 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -69.37 -25.89 30.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.126 0.488 . . . . 0.34000000000000002 111.514 -176.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -36.11 76.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.712 0.767 . . . . 0.34999999999999998 109.698 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.47 2.82 52.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.527 -1.215 . . . . 0.48999999999999999 110.536 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 132' ' ' PHE . 10.9 tp -93.33 134.23 35.75 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.567 -0.742 . . . . 0.70999999999999996 109.321 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.39 153.57 46.07 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.762 -0.732 . . . . 0.76000000000000001 111.838 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -43.07 -38.62 7.49 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.85 3.034 . . . . 1.5600000000000001 113.657 -178.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.06 -54.3 40.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 2.52 110.315 -177.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.408 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -80.84 -28.09 36.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.817 -0.628 . . . . 0.35999999999999999 110.936 -174.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 41.4 ttmt -55.32 -44.37 75.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.626 -0.715 . . . . 2.04 110.278 176.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 87' ' ' LYS . . . -59.98 -42.14 98.19 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.943 -0.646 . . . . 0.40999999999999998 112.02 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -67.2 -43.87 81.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.742 0.306 . . . . 1.6499999999999999 110.985 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -45.38 93.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.372 -0.376 . . . . 0.40999999999999998 111.456 -177.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 33.5 mt-10 -66.42 -23.25 66.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.274 -0.421 . . . . 1.96 111.045 -177.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 83' ' ' GLY . 5.7 mptp? -87.68 -48.48 7.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.365 -0.38 . . . . 2.1200000000000001 111.258 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 10.8 p -61.47 -39.55 91.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.637 0.256 . . . . 0.56999999999999995 111.069 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -59.98 -45.04 95.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 1.0900000000000001 110.866 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.2 -36.4 69.19 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.576 0.227 . . . . 2.8199999999999998 111.323 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 95.0 mt -61.28 -52.2 64.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 0.51000000000000001 110.362 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.16 77.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.64000000000000001 110.801 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -60.61 -42.5 96.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.036 -0.529 . . . . 4.4199999999999999 110.89 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.17 -32.58 84.64 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.008 -0.615 . . . . 0.66000000000000003 111.982 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.8 mm -61.4 -49.27 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.001 0.429 . . . . 0.55000000000000004 110.55 179.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -94.93 21.46 7.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.148 0.499 . . . . 2.7000000000000002 110.576 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -105.23 -34.91 7.74 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.533 -0.758 . . . . 0.63 109.047 168.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.506 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 6.4 ptp180 -80.75 -15.85 55.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.946 -0.57 . . . . 3.1000000000000001 109.61 175.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -65.26 -35.78 82.1 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.135 -0.691 . . . . 0.96999999999999997 109.135 166.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.542 ' CD2' ' HE2' ' A' ' 37' ' ' PHE . 13.4 m-85 -75.27 -46.36 34.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.582 -0.735 . . . . 1.48 112.019 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 41.6 p -60.23 -21.82 62.28 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.865 0.691 . . . . 0.87 112.865 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.16 29.41 5.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.844 -0.693 . . . . 1.1599999999999999 111.957 -174.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -132.77 68.86 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.305 -0.628 . . . . 1.8300000000000001 109.305 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.63 110.68 2.54 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.898 -0.592 . . . . 1.75 111.745 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HG3' ' HG3' ' A' ' 98' ' ' ARG . 78.2 Cg_exo -50.78 148.75 15.53 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.8 3.0 . . . . 0.53000000000000003 113.772 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -88.61 168.76 12.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.788 -0.819 . . . . 1.48 108.788 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.7 tppt? -59.93 -38.39 82.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.403 0.547 . . . . 2.8799999999999999 109.783 -176.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.03 -31.16 72.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.972 -1.013 . . . . 2.2400000000000002 111.258 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -64.15 -44.41 92.2 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.239 0.542 . . . . 1.73 109.837 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.8 mp -68.0 -44.73 75.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.81999999999999995 110.789 177.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 58.4 mtpt -54.66 -46.55 74.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.392 0.615 . . . . 1.74 110.133 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.74 -43.17 94.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.46999999999999997 111.723 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -64.43 -39.17 93.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.977 0.362 . . . . 1.3400000000000001 111.977 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.684 ' O ' HG22 ' A' ' 117' ' ' VAL . 4.3 m -76.74 -27.96 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-O 121.671 0.748 . . . . 0.65000000000000002 109.292 -178.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -62.13 -37.65 85.96 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.9 . . . . 1.72 111.036 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 120' ' ' LEU . 8.7 tt0 -77.35 -34.55 55.11 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 116.453 -0.34 . . . . 2.27 111.147 -175.625 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.684 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -62.02 -34.59 64.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.562 -0.455 . . . . 0.81000000000000005 109.91 171.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.0 mt -72.81 -34.13 66.68 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.281 -0.266 . . . . 1.21 110.281 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -59.85 -42.45 93.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.439 0.638 . . . . 0.94999999999999996 109.344 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.444 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.5 mp -73.58 -45.12 55.16 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.192 -0.913 . . . . 1.0600000000000001 111.288 175.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -72.56 -30.75 64.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.99 -0.684 . . . . 1.54 111.893 -170.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.12 -35.79 81.43 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.006 0.432 . . . . 1.98 110.924 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.98 -4.68 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.896 0.702 . . . . 0.69999999999999996 112.896 -173.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 55.3 mtm -75.0 154.41 38.07 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.425 -0.51 . . . . 0.5 110.902 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.8 m -64.02 140.63 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.269 -0.423 . . . . 1.1799999999999999 110.446 176.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -52.64 -45.75 66.81 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.44 0.533 . . . . 2.21 112.44 -170.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -32.47 70.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.41999999999999998 111.108 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.88 -34.2 53.5 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.484 -0.646 . . . . 0.31 111.484 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -67.37 -44.99 77.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.226 0.536 . . . . 1.3200000000000001 110.371 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.19 -41.66 89.04 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.144 -0.935 . . . . 0.41999999999999998 111.363 178.563 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -71.6 -26.65 62.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.05 -0.977 . . . . 0.55000000000000004 110.407 -174.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.421 ' HA ' HD11 ' A' ' 77' ' ' LEU . 92.2 t80 -63.01 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.753 -0.658 . . . . 0.39000000000000001 109.898 172.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -74.84 -5.45 74.85 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 121.045 -0.597 . . . . 0.27000000000000002 112.92 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -94.41 -37.38 11.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.398 0.618 . . . . 2.4300000000000002 109.874 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 75.1 mm-40 -90.79 -33.84 15.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.004 -0.998 . . . . 1.8300000000000001 110.922 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.499 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 43.4 m-85 -133.38 72.57 74.85 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 0.68999999999999995 110.471 174.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.93 -29.52 67.08 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.984 2.456 . . . . 0.63 111.774 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -64.58 -39.3 93.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.465 -0.789 . . . . 2.3100000000000001 111.029 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.6 mt -81.93 -40.18 22.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.522 -0.308 . . . . 1.02 110.605 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.66 70.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.115 0.483 . . . . 0.34999999999999998 110.127 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.01 -69.59 0.11 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.373 -0.83 . . . . 2.5800000000000001 111.088 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.581 HG21 HD22 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -60.19 -30.71 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.071 -0.968 . . . . 0.5 112.631 -174.504 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.418 ' CD1' HG22 ' A' ' 142' ' ' VAL . 16.3 m-30 -73.65 -47.08 42.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.149 -0.621 . . . . 0.62 110.726 -175.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -74.51 -30.86 61.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.558 -0.292 . . . . 2.5800000000000001 111.639 -175.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 12.4 p -73.04 -16.35 61.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.09 0.471 . . . . 1.3200000000000001 110.636 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLY . . . . . 0.41 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 93.49 1.45 66.29 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.697 -0.763 . . . . 1.0900000000000001 112.696 176.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.39 -45.67 93.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.616 0.246 . . . . 1.98 110.93 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 142' ' ' VAL . . . -66.17 -39.51 89.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.855 0.359 . . . . 0.34000000000000002 110.132 176.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.66 82.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.51000000000000001 111.485 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 11.7 mptt -75.19 -35.7 61.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 2.8199999999999998 111.117 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 45.6 t80 -67.39 -35.43 79.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.099 0.476 . . . . 0.48999999999999999 109.889 174.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.546 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -72.15 -33.8 68.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.586 -0.733 . . . . 0.58999999999999997 111.216 178.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.494 0 CA-C-N 115.619 -0.719 . . . . 1.6200000000000001 112.758 179.557 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' PHE . . . . . 0.618 ' CD2' ' HD3' ' A' ' 30' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.268 0.556 . . . . 1.47 110.895 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . 33.8 mmtp -116.61 146.3 42.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.734 -0.666 . . . . 3.1499999999999999 109.834 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -74.47 -31.36 62.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 2.3500000000000001 109.941 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -75.99 -5.51 46.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.687 -0.688 . . . . 4.1600000000000001 110.439 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 2' ' ' LYS . 20.9 t70 -95.46 -16.51 22.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.002 -0.545 . . . . 2.5699999999999998 109.904 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.499 ' HB ' ' HD2' ' A' ' 11' ' ' ARG . 65.1 mt -70.31 137.72 86.6 Favored Pre-proline 0 C--O 1.236 0.353 0 N-CA-C 108.961 -0.755 . . . . 0.68999999999999995 108.961 175.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -42.24 116.2 0.58 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.463 . . . . 0.59999999999999998 112.111 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.94 -16.75 64.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.56999999999999995 112.045 -173.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.14 -30.39 60.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.835 0.826 . . . . 1.3700000000000001 109.68 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -82.95 -29.37 29.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.55 -1.205 . . . . 0.80000000000000004 110.849 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.499 ' HD2' ' HB ' ' A' ' 6' ' ' ILE . 45.5 mtp180 -70.8 -17.42 62.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.49 0.662 . . . . 1.73 109.952 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -72.14 -22.88 61.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.872 -1.058 . . . . 1.02 110.612 176.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.419 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 85.2 mt -89.35 -12.28 40.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.191 -0.459 . . . . 0.93000000000000005 111.182 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 66.1 mtt -75.82 124.64 88.7 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.428 -0.351 . . . . 1.1499999999999999 110.801 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.504 ' HD3' HD21 ' A' ' 139' ' ' LEU . 54.0 Cg_endo -71.99 153.36 57.86 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.566 2.177 . . . . 0.90000000000000002 111.558 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -45.49 -53.88 5.04 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.593 2.862 . . . . 0.95999999999999996 113.59 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.583 ' O ' HD21 ' A' ' 66' ' ' LEU . 44.0 mt-10 -59.87 -38.12 81.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.749 0.309 . . . . 1.8300000000000001 111.585 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.47 58.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.726 0.298 . . . . 0.81999999999999995 111.1 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 23.0 mtm180 -73.83 -45.03 53.78 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.161 -0.472 . . . . 2.1600000000000001 110.409 177.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -47.65 -44.87 27.39 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.112 0.883 . . . . 1.0600000000000001 111.473 -172.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.405 ' O ' HD23 ' A' ' 25' ' ' LEU . 38.5 t80 -59.94 -67.27 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.022 -0.535 . . . . 0.65000000000000002 111.632 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.545 HD21 ' OH ' ' A' ' 100' ' ' TYR . 24.1 mt -70.61 -11.04 60.68 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.74 1.155 . . . . 1.1299999999999999 112.493 -177.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.65 -40.79 88.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.257 0.551 . . . . 2.0600000000000001 109.769 163.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -74.7 -48.25 26.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.346 -0.843 . . . . 1.8400000000000001 112.041 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 59' ' ' LEU . 4.0 mm? -58.76 140.64 54.66 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.537 0.684 . . . . 1.05 111.852 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.2 p -139.94 -169.47 2.74 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.653 -1.158 . . . . 1.78 109.531 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.17 150.71 33.46 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.765 -0.457 . . . . 2.3900000000000001 109.765 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.51 -53.8 4.38 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.501 -0.857 . . . . 0.93000000000000005 111.322 -174.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 32' ' ' VAL . 16.2 m-20 -66.57 -44.78 81.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.523 0.677 . . . . 2.25 109.525 177.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.618 ' HD3' ' CD2' ' A' ' 1' ' ' PHE . 89.9 mttt -72.07 -12.58 61.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.321 -0.854 . . . . 1.3100000000000001 110.664 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -76.46 -43.43 39.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.892 -0.594 . . . . 0.80000000000000004 109.711 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.36 -29.93 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 115.431 -0.804 . . . . 0.84999999999999998 110.498 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.642 HD23 HD21 ' A' ' 52' ' ' LEU . 23.4 mt -56.18 -42.74 77.58 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.869 0.366 . . . . 0.97999999999999998 110.768 171.027 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 39.6 ttmt -54.56 -42.1 70.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.903 -0.59 . . . . 2.4100000000000001 110.929 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.942 -0.572 . . . . 1.96 111.548 -176.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.86 -52.26 11.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.513 0.673 . . . . 0.97999999999999998 109.564 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.532 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 47.5 m-85 -58.32 -50.47 73.52 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 115.223 1.564 . . . . 0.82999999999999996 115.223 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 15.5 ptpt -86.54 18.04 3.53 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.42 -0.912 . . . . 2.1800000000000002 111.729 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.46 -78.67 0.59 Allowed 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.509 -0.768 . . . . 1.5600000000000001 109.388 169.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 44.77 -151.37 0.75 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 121.084 -0.579 . . . . 1.54 113.22 -175.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 9.3 Cg_endo -89.28 147.0 22.42 Favored 'Cis proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.986 -1.256 . . . . 1.6799999999999999 111.318 -6.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.431 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 36.0 m-85 -118.02 114.05 22.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.775 -0.648 . . . . 1.28 110.566 -175.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HG3' HD22 ' A' ' 44' ' ' ASN . 13.4 ptmm? -73.19 -7.21 50.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.407 -0.815 . . . . 3.5099999999999998 111.239 177.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.527 HD22 ' HG3' ' A' ' 43' ' ' LYS . 8.4 p30 -150.03 161.97 41.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.902 -0.407 . . . . 1.52 109.902 -178.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 49' ' ' ILE . 19.9 m -73.51 -28.01 61.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.289 -0.414 . . . . 1.1799999999999999 110.86 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 38.2 mt-10 -59.51 -40.98 88.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 2.2400000000000002 111.113 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.431 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.9 mt-10 -62.99 -35.17 79.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.738 0.304 . . . . 2.2599999999999998 111.145 176.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.4 m -69.93 -40.84 75.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.156 0.503 . . . . 1.1899999999999999 110.006 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 45' ' ' THR . 76.2 mt -65.08 -42.72 95.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.55000000000000004 110.212 177.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.31 80.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.298 -0.864 . . . . 0.56999999999999995 111.285 176.052 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.74 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.433 0.635 . . . . 0.5 110.258 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.642 HD21 HD23 ' A' ' 33' ' ' LEU . 36.4 mt -69.86 -36.35 75.43 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.202 -0.908 . . . . 0.45000000000000001 111.395 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -65.12 -30.24 71.16 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.926 -0.31 . . . . 1.22 111.147 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -75.0 -44.37 48.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.206 0.527 . . . . 3.0499999999999998 110.402 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.46 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 52.3 mmtt -68.71 -55.95 9.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.711 . . . . 1.48 111.607 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 m -142.54 95.7 6.43 Favored Pre-proline 0 C--N 1.315 -0.93 0 N-CA-C 110.214 -0.291 . . . . 1.1599999999999999 110.214 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.34 -59.61 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.96 3.107 . . . . 0.57999999999999996 113.95 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -66.88 -22.07 65.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.49 -0.777 . . . . 2.4500000000000002 112.286 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 3.4 tt -73.85 -41.53 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.602 -1.258 . . . . 1.4199999999999999 107.602 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -64.3 -33.11 86.36 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 114.264 -1.334 . . . . 0.37 111.311 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -65.42 -39.86 92.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.796 0.331 . . . . 0.47999999999999998 110.272 173.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 59' ' ' LEU . 16.5 tppt? -57.0 -57.42 12.64 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.638 -0.71 . . . . 2.1699999999999999 110.916 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 8.1 p -63.48 -35.65 73.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.327 -0.397 . . . . 1.1200000000000001 111.246 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.26 -64.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.228 -0.442 . . . . 1.7 111.458 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HD3' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.55 -32.12 73.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.251 0.548 . . . . 3.96 110.788 -173.016 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.4 tm? -67.29 -46.54 73.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.389 -0.823 . . . . 1.5 110.143 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -24.74 57.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.911 -0.774 . . . . 2.3399999999999999 108.911 -175.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.67 81.94 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.923 -1.035 . . . . 0.40000000000000002 111.804 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.5 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 34.6 mtm -65.08 -50.73 65.0 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.321 -0.622 . . . . 0.71999999999999997 109.321 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.482 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 89.0 t -53.7 -43.62 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 114.795 -1.093 . . . . 0.79000000000000004 110.238 174.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -60.82 -40.17 91.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.311 -0.859 . . . . 1.47 110.683 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.8 m -63.3 -39.31 94.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.641 0.258 . . . . 1.26 111.048 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 69' ' ' MET . 32.9 mmtp -66.64 -43.87 83.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 1.54 110.225 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.487 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 77.9 mt -72.51 -23.44 21.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.242 0.544 . . . . 0.34000000000000002 111.021 178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.14 -30.44 67.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.584 0.707 . . . . 0.34999999999999998 110.184 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.85 2.91 56.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.863 -1.062 . . . . 0.48999999999999999 110.761 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.505 HD13 ' CG ' ' A' ' 135' ' ' GLN . 11.5 tp -95.76 132.67 40.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.715 -0.675 . . . . 0.70999999999999996 110.378 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.86 151.24 49.56 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.894 -0.67 . . . . 0.76000000000000001 112.061 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -41.07 -42.83 4.84 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 124.075 3.183 . . . . 1.5600000000000001 114.312 -176.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -60.53 -51.7 68.32 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.417 0.627 . . . . 2.52 110.305 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.533 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.63 -30.74 32.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.146 -0.934 . . . . 0.35999999999999999 110.646 -173.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 27.7 ttpp -59.3 -44.59 92.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 2.04 110.518 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.68 -41.68 90.23 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.683 -0.77 . . . . 0.40999999999999998 111.436 178.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.12 -48.84 66.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.269 . . . . 1.6499999999999999 111.225 175.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.28 -45.6 76.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.167 0.508 . . . . 0.40999999999999998 111.388 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.647 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 38.8 mt-10 -67.83 -43.37 79.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 1.96 110.419 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -66.35 -44.04 84.39 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.731 0.301 . . . . 2.1200000000000001 111.301 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.2 p -62.77 -41.48 99.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.347 -0.388 . . . . 0.56999999999999995 110.914 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.649 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 28.8 mt -64.59 -39.77 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 116.376 -0.374 . . . . 1.0900000000000001 110.843 177.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.647 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.3 mt-10 -52.97 -44.26 67.02 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.969 0.414 . . . . 2.8199999999999998 110.646 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 48.3 mt -69.55 -44.25 79.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.827 -0.624 . . . . 0.51000000000000001 110.753 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.95 -22.55 64.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.64000000000000001 111.28 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 39.2 mtm180 -63.41 -50.25 70.59 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.803 -0.443 . . . . 4.4199999999999999 109.803 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.96 -35.76 92.41 Favored Glycine 0 N--CA 1.453 -0.219 0 CA-C-N 115.961 -0.563 . . . . 0.66000000000000003 113.185 -172.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.4 -49.44 83.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.991 0.424 . . . . 0.55000000000000004 110.664 -178.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -94.89 7.02 47.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.373 -0.376 . . . . 2.7000000000000002 111.033 -179.095 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -86.24 -30.83 22.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.218 -0.66 . . . . 0.63 109.218 167.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.519 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 61.1 mtp180 -83.24 -7.72 59.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.749 -0.66 . . . . 3.1000000000000001 109.404 174.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.471 ' CE1' ' HD2' ' A' ' 105' ' ' PRO . 8.4 m-85 -80.05 -26.13 39.84 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.084 -0.71 . . . . 0.96999999999999997 109.084 166.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.545 ' OH ' HD21 ' A' ' 22' ' ' LEU . 23.1 m-85 -80.14 -49.26 11.95 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.131 -0.486 . . . . 1.48 110.723 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.534 ' HA ' ' HG3' ' A' ' 34' ' ' LYS . 55.1 p -63.97 -22.33 66.88 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.756 -0.656 . . . . 0.87 112.501 -174.212 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.47 11.1 45.71 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.7 -0.762 . . . . 1.1599999999999999 112.715 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.519 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 58.1 t30 -111.35 66.85 0.63 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.675 -0.491 . . . . 1.8300000000000001 109.675 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.77 123.21 37.66 Favored Pre-proline 0 N--CA 1.464 0.229 0 CA-C-N 115.259 -0.882 . . . . 1.75 112.35 -172.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PRO . . . . . 0.471 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 44.9 Cg_endo -69.48 155.04 67.98 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.985 2.457 . . . . 0.53000000000000003 111.995 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.455 ' O ' HD13 ' A' ' 110' ' ' LEU . 80.6 p -83.79 173.92 10.88 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.933 -0.395 . . . . 1.48 109.933 176.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -65.08 -27.67 68.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.236 0.541 . . . . 2.8799999999999999 109.807 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -72.8 -29.58 63.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.877 -0.601 . . . . 2.2400000000000002 110.225 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.71 -44.1 97.58 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-O 121.292 0.567 . . . . 1.73 109.642 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 106' ' ' THR . 7.0 mp -65.18 -45.13 86.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.328 -0.851 . . . . 0.81999999999999995 110.939 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -58.38 -42.02 86.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.173 0.511 . . . . 1.74 110.127 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -63.5 -42.94 98.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.721 -0.672 . . . . 0.46999999999999997 111.412 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.498 ' O ' HG13 ' A' ' 117' ' ' VAL . 77.5 p -63.26 -34.98 78.85 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.771 -0.372 . . . . 1.3400000000000001 111.964 -178.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.611 ' O ' HG22 ' A' ' 117' ' ' VAL . 5.5 m -87.1 -27.3 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.221 0.534 . . . . 0.65000000000000002 110.537 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 14.6 ptpt -71.07 -30.63 66.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.47 . . . . 1.72 110.973 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.61 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.0 mt-10 -77.5 -36.19 52.8 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 119.839 -0.744 . . . . 2.27 110.63 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.41 -28.15 42.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 120.287 -0.565 . . . . 0.81000000000000005 109.68 175.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.482 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.3 mt -73.92 -38.97 64.14 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.637 -0.505 . . . . 1.21 109.637 173.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -58.65 -49.2 78.42 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.438 -0.579 . . . . 0.94999999999999996 109.438 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.4 mm? -61.43 -46.81 88.54 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.662 -0.699 . . . . 1.0600000000000001 112.052 173.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -32.12 64.51 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 118.513 -1.275 . . . . 1.54 111.862 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.079 0.466 . . . . 1.98 110.654 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.2 59.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.698 . . . . 0.69999999999999996 112.577 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.533 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 60.6 mtm -72.71 151.03 42.4 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.662 -0.815 . . . . 0.5 110.042 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.3 p -63.43 150.32 43.9 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 1.1799999999999999 110.145 173.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -55.55 -43.29 75.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.557 0.218 . . . . 2.21 111.501 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.31 -25.15 66.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.137 -0.483 . . . . 0.41999999999999998 111.464 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.46 -36.1 24.34 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.87 -0.681 . . . . 0.31 111.646 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 124' ' ' MET . 98.5 mttt -63.14 -45.92 89.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.211 0.529 . . . . 1.3200000000000001 110.502 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ALA . . . . . 0.529 ' O ' ' HE3' ' A' ' 134' ' ' LYS . . . -66.89 -33.85 76.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.544 -0.753 . . . . 0.41999999999999998 111.335 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -74.79 -32.26 61.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.914 0.388 . . . . 0.55000000000000004 110.049 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.47 -32.36 71.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.968 -0.56 . . . . 0.39000000000000001 110.088 172.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -67.14 -18.65 69.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.889 -0.596 . . . . 0.27000000000000002 113.067 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.529 ' HE3' ' O ' ' A' ' 130' ' ' ALA . 23.2 mmtp -82.8 -29.37 29.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.468 0.651 . . . . 2.4300000000000002 110.065 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.505 ' CG ' HD13 ' A' ' 77' ' ' LEU . 6.2 mm100 -96.23 -40.8 8.99 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.041 -0.981 . . . . 1.8300000000000001 110.976 -174.013 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.482 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 70.5 m-85 -131.18 74.1 79.74 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.984 0.421 . . . . 0.68999999999999995 109.958 176.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.8 -34.55 72.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.104 2.536 . . . . 0.63 112.621 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 47.8 t80 -64.58 -34.34 78.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.884 0.373 . . . . 2.3100000000000001 110.616 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.512 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 86.6 mt -78.84 -47.43 16.63 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.845 -0.342 . . . . 1.02 110.375 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.03 -33.62 67.38 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.185 0.516 . . . . 0.34999999999999998 109.777 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.553 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.8 tttp -51.09 -73.37 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.89 -1.05 . . . . 2.5800000000000001 111.525 171.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 148' ' ' ALA . 1.1 m -72.17 -13.76 16.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.346 -0.843 . . . . 0.5 112.91 -171.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.2 m-30 -80.21 -44.81 19.1 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.41 -0.516 . . . . 0.62 110.259 175.306 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.84 -43.05 84.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.861 -0.609 . . . . 2.5800000000000001 110.386 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.4 m -76.85 156.83 31.9 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.96 -0.755 . . . . 1.3200000000000001 108.96 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -79.28 48.74 3.43 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.509 -0.853 . . . . 1.0900000000000001 112.763 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.419 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 1.7 tmtp? -100.64 -65.87 0.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.123 -0.325 . . . . 1.98 110.123 -178.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' ALA . . . . . 0.538 ' HB2' HG23 ' A' ' 142' ' ' VAL . . . -64.86 -38.38 90.8 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.061 0.458 . . . . 0.34000000000000002 109.86 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.482 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -55.55 -44.73 77.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.292 -0.867 . . . . 0.51000000000000001 110.763 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.05 -38.14 82.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 2.8199999999999998 110.269 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -58.43 -41.85 85.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 0.48999999999999999 110.255 177.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.584 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.47 -27.99 63.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.741 -0.663 . . . . 0.58999999999999997 111.769 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.691 0 N-CA-C 111.314 -0.714 . . . . 1.6200000000000001 111.314 -175.254 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.469 0.652 . . . . 1.47 112.444 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -104.89 135.06 46.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.348 -0.842 . . . . 3.1499999999999999 109.704 176.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.35 -39.93 94.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.08 -0.963 . . . . 2.3500000000000001 112.621 -168.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -93.67 18.59 9.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.18 0.514 . . . . 4.1600000000000001 111.131 -177.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -98.44 0.87 46.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.951 0.881 . . . . 2.5699999999999998 109.092 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.9 mt -81.9 131.93 55.66 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.946 -1.025 . . . . 0.68999999999999995 109.169 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.83 114.79 0.57 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.304 2.67 . . . . 0.59999999999999998 112.349 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.65 66.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.772 -0.649 . . . . 0.56999999999999995 111.481 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -65.21 -34.92 79.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.9 0.857 . . . . 1.3700000000000001 109.697 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 90.7 t80 -82.81 -33.36 27.25 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.447 -1.252 . . . . 0.80000000000000004 110.369 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.543 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 41.1 mtp85 -64.2 -24.86 67.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.324 0.583 . . . . 1.73 110.26 -178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -63.64 -27.02 68.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.02 110.866 176.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 mt -94.23 -19.25 20.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.93000000000000005 110.971 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 91.5 mtp -65.73 131.29 94.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 1.1499999999999999 111.653 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.5 Cg_exo -60.51 137.1 71.71 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.657 2.238 . . . . 0.90000000000000002 111.363 176.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.3 Cg_exo -52.02 -31.24 43.35 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.618 2.878 . . . . 0.95999999999999996 112.916 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -62.56 -49.5 75.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.075 0.464 . . . . 1.8300000000000001 110.541 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.08 65.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 0.81999999999999995 110.909 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -78.56 -44.38 24.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.786 -0.643 . . . . 2.1600000000000001 111.307 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 32.2 t70 -51.71 -49.47 62.42 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.46 0.475 . . . . 1.0600000000000001 112.195 -176.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' HB2' HD22 ' A' ' 66' ' ' LEU . 54.1 t80 -55.93 -58.49 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.378 -0.374 . . . . 0.65000000000000002 111.728 177.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 25' ' ' LEU . 80.1 mt -72.55 -13.11 61.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.894 0.77 . . . . 1.1299999999999999 111.329 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 51.7 tt0 -65.01 -49.47 70.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.688 0.28 . . . . 2.0600000000000001 110.957 167.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -86.84 -30.79 21.2 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.992 0.367 . . . . 1.8400000000000001 111.992 -175.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 22' ' ' LEU . 14.9 tp -67.54 131.25 45.29 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-O 121.328 0.585 . . . . 1.05 110.407 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 14.2 t -119.22 168.6 10.73 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.414 -0.812 . . . . 1.78 110.011 -172.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 0.8 OUTLIER -54.66 -44.4 73.25 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.335 0.865 . . . . 2.3900000000000001 113.335 -169.926 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.83 -38.33 83.1 Favored Glycine 0 N--CA 1.454 -0.156 0 C-N-CA 120.833 -0.699 . . . . 0.93000000000000005 111.938 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 32' ' ' VAL . 49.7 m-20 -79.61 -38.63 33.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.433 0.159 . . . . 2.25 110.626 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 26' ' ' SER . 82.1 mttt -54.65 -27.95 43.55 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.152 0.501 . . . . 1.3100000000000001 110.237 176.281 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.404 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 74.7 m -59.36 -36.33 75.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.425 -0.807 . . . . 0.80000000000000004 111.522 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 29' ' ' ASP . 6.1 p -89.22 -24.58 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 116.211 -0.45 . . . . 0.84999999999999998 110.794 -174.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.64 HD13 HD21 ' A' ' 52' ' ' LEU . 4.3 mm? -50.2 -52.01 39.28 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.345 -0.389 . . . . 0.97999999999999998 111.318 173.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 46.2 pttt -66.19 -21.22 66.31 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.107 0.41 . . . . 2.4100000000000001 112.107 -176.253 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -70.71 -27.99 64.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.159 0.504 . . . . 1.96 110.184 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.96 -51.89 16.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.726 . . . . 0.97999999999999998 109.967 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.54 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 49.7 m-85 -60.71 -45.76 92.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.899 1.444 . . . . 0.82999999999999996 114.899 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.9 -20.95 60.24 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.012 -0.675 . . . . 2.1800000000000002 110.504 -177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.23 -76.6 0.13 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.903 -0.59 . . . . 1.5600000000000001 109.907 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.405 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 48.32 -158.38 0.83 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.077 -0.582 . . . . 1.54 112.693 -176.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -95.03 138.01 5.9 Favored 'Cis proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.184 -1.173 . . . . 1.6799999999999999 111.175 -9.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 41.7 m-85 -114.27 108.18 16.59 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.56 0.695 . . . . 1.28 110.916 -173.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.45 -8.93 29.33 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.435 -1.257 . . . . 3.5099999999999998 111.0 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -137.79 163.54 31.11 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.617 -0.883 . . . . 1.52 108.617 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.9 m -85.33 -33.29 22.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.797 0.332 . . . . 1.1799999999999999 110.379 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.449 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.1 mp0 -56.61 -34.28 67.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 2.2400000000000002 111.702 179.343 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.6 OUTLIER -68.57 -38.07 80.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.74 0.305 . . . . 2.2599999999999998 111.242 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.5 m -66.52 -39.34 88.57 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.507 -0.553 . . . . 1.1899999999999999 109.507 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 64' ' ' GLU . 97.0 mt -61.79 -44.66 99.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.254 -0.885 . . . . 0.55000000000000004 110.108 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.77 -48.69 80.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.56999999999999995 111.861 176.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.48 87.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.304 0.573 . . . . 0.5 110.214 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.64 HD21 HD13 ' A' ' 33' ' ' LEU . 29.0 mt -66.49 -38.06 86.44 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.184 -0.916 . . . . 0.45000000000000001 111.331 178.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.27 -39.44 92.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.838 0.351 . . . . 1.22 111.547 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -71.24 -44.62 64.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.41 -0.359 . . . . 3.0499999999999998 111.123 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HB3' HG21 ' A' ' 32' ' ' VAL . 25.3 mmtt -68.73 -48.79 62.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.125 -0.489 . . . . 1.48 111.931 177.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.2 m -145.4 96.9 4.78 Favored Pre-proline 0 C--N 1.313 -1.004 0 O-C-N 122.234 -0.291 . . . . 1.1599999999999999 110.502 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -41.8 -56.79 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.809 3.006 . . . . 0.57999999999999996 113.209 -170.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.475 ' HG2' ' HE3' ' A' ' 62' ' ' LYS . 37.0 tt0 -60.21 -35.41 75.36 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.533 -1.212 . . . . 2.4500000000000002 112.436 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 29' ' ' ASP . 62.1 mt -69.6 -40.61 76.56 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 119.406 -0.917 . . . . 1.4199999999999999 109.05 -175.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.73 -38.43 96.18 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 114.311 -1.313 . . . . 0.37 111.691 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.9 95.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.745 0.307 . . . . 0.47999999999999998 110.49 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HE3' ' HG2' ' A' ' 58' ' ' GLU . 98.7 mttt -62.45 -58.73 6.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.013 -0.539 . . . . 2.1699999999999999 110.913 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 11.5 p -62.88 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 1.1200000000000001 111.425 -177.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.525 ' HA ' HD13 ' A' ' 49' ' ' ILE . 38.3 tt0 -67.0 -57.73 6.3 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 121.011 -0.276 . . . . 1.7 111.016 178.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' MET . 0.1 OUTLIER -64.67 -31.19 72.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.619 0.723 . . . . 3.96 109.706 -175.468 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.562 HD22 ' HB2' ' A' ' 21' ' ' PHE . 21.5 tp -67.79 -38.15 82.95 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.707 -1.133 . . . . 1.5 110.49 177.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -79.36 -31.65 43.02 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.974 -0.75 . . . . 2.3399999999999999 108.974 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.42 95.45 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.851 -1.068 . . . . 0.40000000000000002 111.138 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 43.9 mtm -58.79 -55.72 31.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.892 -0.41 . . . . 0.71999999999999997 109.892 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 66' ' ' LEU . 95.2 t -50.93 -46.82 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 115.366 -0.834 . . . . 0.79000000000000004 110.949 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 12.8 mtpt -66.17 -33.92 76.86 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.662 -0.699 . . . . 1.47 112.308 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.4 t -56.6 -41.56 77.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.086 0.47 . . . . 1.26 110.649 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 3.9 mptp? -69.6 -45.33 68.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.963 -0.562 . . . . 1.54 110.061 177.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -67.94 -25.27 31.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.221 0.534 . . . . 0.34000000000000002 110.889 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.27 -33.77 73.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.709 0.766 . . . . 0.34999999999999998 109.939 173.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.01 -1.94 58.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.741 -1.118 . . . . 0.48999999999999999 110.83 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.9 tp -93.95 137.97 32.58 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.731 -0.668 . . . . 0.70999999999999996 109.894 -175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.97 149.28 51.46 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.393 -0.67 . . . . 0.76000000000000001 112.037 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -37.95 -42.85 1.48 Allowed 'Trans proline' 0 N--CA 1.478 0.603 0 C-N-CA 124.666 3.577 . . . . 1.5600000000000001 114.741 -176.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -70.14 -51.37 31.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.552 0.215 . . . . 2.52 110.683 -177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.49 -33.46 69.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.711 0.767 . . . . 0.35999999999999999 109.825 -177.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -57.2 -45.92 83.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.401 -1.272 . . . . 2.04 110.927 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.24 97.93 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.654 -0.784 . . . . 0.40999999999999998 111.738 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.526 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 6.5 t80 -62.49 -48.02 81.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.359 -0.237 . . . . 1.6499999999999999 110.359 175.503 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.691 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -56.83 -56.95 14.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.274 . . . . 0.40999999999999998 111.385 -178.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 30.3 mt-10 -62.7 -25.13 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 1.96 111.408 -174.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.451 ' O ' HG13 ' A' ' 91' ' ' ILE . 53.5 tttp -86.75 -41.46 14.11 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.641 -0.254 . . . . 2.1200000000000001 111.05 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.8 p -66.75 -39.47 87.92 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.683 -0.235 . . . . 0.56999999999999995 111.158 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 85' ' ' ALA . 51.7 mm -58.12 -40.14 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 110.077 -0.342 . . . . 1.0900000000000001 110.077 176.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 75.5 mm-40 -63.61 -34.49 77.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.11 -0.495 . . . . 2.8199999999999998 111.246 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 87' ' ' LYS . 53.2 mt -65.82 -49.6 76.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.777 0.323 . . . . 0.51000000000000001 110.482 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.92 -36.01 79.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.683 -0.488 . . . . 0.64000000000000001 109.683 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -56.91 -40.62 76.62 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.468 -0.787 . . . . 4.4199999999999999 110.763 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.86 -36.47 82.03 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.899 -0.667 . . . . 0.66000000000000003 112.46 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 110' ' ' LEU . 45.4 mm -67.62 -49.59 68.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.256 0.551 . . . . 0.55000000000000004 110.071 178.414 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.7 ptmm? -80.68 2.37 26.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 2.7000000000000002 111.131 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.66 -26.37 27.83 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.89 -0.782 . . . . 0.63 108.89 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.1 mtp180 -86.86 -1.56 57.89 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 3.1000000000000001 109.866 174.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -90.84 -22.11 21.13 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.909 -0.404 . . . . 0.96999999999999997 109.909 165.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.564 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 30.8 m-85 -84.82 -45.04 12.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.96 0.409 . . . . 1.48 110.731 176.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.57 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 16.7 p -70.17 -20.97 63.1 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.005 0.743 . . . . 0.87 113.005 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 98.28 1.47 58.07 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.762 -0.733 . . . . 1.1599999999999999 112.789 -174.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASN . . . . . 0.625 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 21.5 m120 -92.64 56.97 2.8 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 122.706 -0.29 . . . . 1.8300000000000001 110.732 -178.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -43.72 123.21 3.81 Favored Pre-proline 0 N--CA 1.469 0.476 0 O-C-N 124.128 0.893 . . . . 1.75 112.374 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.0 155.52 38.4 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.946 2.431 . . . . 0.53000000000000003 112.177 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -94.17 177.95 5.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.96 -0.756 . . . . 1.48 108.96 173.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.0 ptpp? -62.77 -31.14 72.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.036 -0.666 . . . . 2.8799999999999999 110.86 -175.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -61.81 -38.28 87.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.605 -0.271 . . . . 2.2400000000000002 110.777 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -63.54 -45.0 92.55 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.28 0.562 . . . . 1.73 110.3 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 95' ' ' ILE . 40.4 mt -67.24 -41.93 84.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.296 -0.865 . . . . 0.81999999999999995 110.895 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 59.1 mtpt -60.98 -41.75 97.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.973 0.416 . . . . 1.74 110.021 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.55 -39.44 93.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.939 -0.573 . . . . 0.46999999999999997 111.291 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 117' ' ' VAL . 73.7 p -66.28 -33.6 76.11 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.392 0.515 . . . . 1.3400000000000001 112.392 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.58 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.2 m -85.85 -25.81 6.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.868 0.842 . . . . 0.65000000000000002 109.404 -179.033 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 10.3 ttpt -61.5 -46.11 91.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.589 -1.187 . . . . 1.72 111.405 -178.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.491 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.1 mt-10 -73.01 -33.88 66.03 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.666 -0.414 . . . . 2.27 111.793 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.5 m -64.13 -34.67 70.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.235 -0.586 . . . . 0.81000000000000005 110.457 178.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.43 ' CD2' ' HB2' ' A' ' 149' ' ' ALA . 5.0 mp -76.79 -30.01 56.26 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.281 -0.568 . . . . 1.21 110.471 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -62.07 -38.21 87.92 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.168 -0.679 . . . . 0.94999999999999996 109.168 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.1 mp -76.74 -47.5 21.61 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.234 -0.894 . . . . 1.0600000000000001 111.925 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.526 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 12.9 t80 -72.76 -39.48 66.76 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.469 -0.493 . . . . 1.54 111.938 -168.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -65.42 -36.66 84.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.368 0.604 . . . . 1.98 110.142 178.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.57 -2.1 24.43 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.7 -1.136 . . . . 0.69999999999999996 112.99 -176.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 74.0 mtm -78.63 153.05 31.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.494 -0.928 . . . . 0.5 108.494 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -53.43 -79.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.402 0.546 . . . . 1.1799999999999999 111.083 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.502 ' HA ' ' HG2' ' A' ' 129' ' ' LYS . 24.0 t70 -168.78 -47.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.358 -0.214 . . . . 2.21 110.956 175.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.56 74.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.264 -0.425 . . . . 0.41999999999999998 110.855 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.18 -40.75 28.45 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.444 -0.798 . . . . 0.31 112.685 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 126' ' ' ASP . 4.5 ptpp? -70.81 -35.96 72.76 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.345 -0.542 . . . . 1.3200000000000001 110.528 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.94 -23.43 60.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.41999999999999998 110.699 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASP . . . . . 0.469 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 35.6 t70 -78.86 -32.33 45.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.55000000000000004 109.653 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.39 -28.26 69.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.491 -0.777 . . . . 0.39000000000000001 109.855 173.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.39 -16.73 69.68 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.27000000000000002 113.211 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 64.8 mttt -86.34 -40.31 15.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 121.628 0.728 . . . . 2.4300000000000002 109.643 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 1.8 mp0 -78.44 -43.45 27.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.753 -1.112 . . . . 1.8300000000000001 111.281 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' PHE . . . . . 0.444 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 65.7 m-85 -128.1 77.32 76.89 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.68999999999999995 110.025 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.36 -36.5 44.71 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.319 2.68 . . . . 0.63 113.333 -172.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' PHE . . . . . 0.576 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 52.3 t80 -62.41 -40.77 97.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 2.3100000000000001 111.373 -175.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 143' ' ' PHE . 92.2 mt -75.2 -45.6 39.41 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.855 -0.338 . . . . 1.02 110.651 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.88 71.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.34999999999999998 110.291 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.9 tttt -52.42 -72.08 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 2.5800000000000001 111.175 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.575 ' HB ' ' CB ' ' A' ' 147' ' ' LYS . 2.4 m -64.56 -31.71 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.195 -0.911 . . . . 0.5 113.004 -171.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 139' ' ' LEU . 21.3 m-30 -63.88 -29.05 70.27 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.983 0.421 . . . . 0.62 110.92 -177.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -91.19 -12.19 36.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.499 . . . . 2.5800000000000001 111.558 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 26.4 t -118.24 46.88 1.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.19 0.519 . . . . 1.3200000000000001 110.098 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 69.68 -99.6 0.68 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.9 -0.667 . . . . 1.0900000000000001 111.607 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' LYS . . . . . 0.575 ' CB ' ' HB ' ' A' ' 142' ' ' VAL . 31.2 mmtm 48.12 -95.54 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 113.064 0.764 . . . . 1.98 113.064 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.24 90.38 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.054 0.454 . . . . 0.34000000000000002 110.395 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 118' ' ' LEU . . . -64.1 -43.14 96.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.51000000000000001 110.295 176.11 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -66.26 -35.87 81.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.241 0.543 . . . . 2.8199999999999998 110.176 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 56.6 t80 -62.29 -38.11 88.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.345 -0.843 . . . . 0.48999999999999999 110.722 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ALA . . . . . 0.425 ' HB2' ' CG2' ' A' ' 114' ' ' VAL . . . -94.01 6.25 49.11 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.734 -0.666 . . . . 0.58999999999999997 111.985 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.945 -1.262 . . . . 1.6200000000000001 109.945 -175.403 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 20.2 ptp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.532 0.206 . . . . 23.59 110.593 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 134.54 -160.41 24.2 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.814 -0.707 . . . . 22.469999999999999 112.463 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 9.8 p -68.07 -13.16 61.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.545 0.338 . . . . 21.510000000000002 111.709 -178.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 7.5 p -68.21 -20.59 64.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.967 0.413 . . . . 20.190000000000001 110.853 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -92.02 8.03 39.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.553 0.692 . . . . 21.420000000000002 109.35 177.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -111.98 -173.55 2.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 18.199999999999999 109.779 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -61.22 153.46 26.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.805 0.336 . . . . 16.059999999999999 110.425 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -7' ' ' HIS . . . . . 0.437 ' O ' ' HB2' ' A' ' -6' ' ' HIS . 55.6 m-70 -112.52 153.44 27.46 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.297 -0.631 . . . . 13.27 109.297 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -6' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' -7' ' ' HIS . 44.4 m170 72.01 126.91 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 O-C-N 123.755 0.66 . . . . 12.33 111.189 -176.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -152.77 -35.96 0.11 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.181 -0.463 . . . . 11.33 110.972 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 15.3 m -123.7 12.87 9.26 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.95 -0.3 . . . . 7.9500000000000002 111.318 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.3 m -136.18 10.8 3.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.731 0.3 . . . . 7.3600000000000003 111.484 -178.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -108.04 -39.49 1.83 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.335 -0.936 . . . . 4.5700000000000003 112.529 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -68.79 122.79 19.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 4.5199999999999996 110.696 -178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.452 ' HG2' ' OD2' ' A' ' 27' ' ' ASP . 36.8 tpp -143.25 126.64 16.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.632 -0.713 . . . . 2.0 110.487 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.539 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 18.4 t80 -56.27 128.12 34.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.277 -0.874 . . . . 1.47 112.221 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -123.27 124.18 42.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.662 -0.699 . . . . 3.1499999999999999 109.343 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.412 ' CD1' HD12 ' A' ' 6' ' ' ILE . 56.8 t80 -67.77 -17.61 64.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.276 0.56 . . . . 2.3500000000000001 110.513 -175.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -82.59 -9.02 59.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.404 -0.816 . . . . 4.1600000000000001 110.337 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -97.87 -7.63 29.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.074 -0.512 . . . . 2.5699999999999998 110.799 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.412 HD12 ' CD1' ' A' ' 3' ' ' TYR . 52.5 mt -75.47 135.88 71.95 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.295 -0.632 . . . . 0.68999999999999995 109.295 177.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.96 112.11 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.658 2.239 . . . . 0.59999999999999998 111.508 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.4 -22.21 66.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.56999999999999995 112.005 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.76 -30.88 71.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 122.023 0.916 . . . . 1.3700000000000001 109.533 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -88.81 -26.25 21.79 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.037 -1.438 . . . . 0.80000000000000004 110.736 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -72.96 -19.58 61.21 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.681 0.753 . . . . 1.73 109.5 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -72.03 -23.74 61.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.694 -1.139 . . . . 1.02 110.421 172.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.534 HD21 ' CD ' ' A' ' 147' ' ' LYS . 86.8 mt -94.5 17.69 12.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.852 -0.613 . . . . 0.93000000000000005 112.046 -175.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.454 ' SD ' ' HG2' ' A' ' 19' ' ' ARG . 19.4 ptp -128.08 145.16 54.29 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 120.795 -0.362 . . . . 1.1499999999999999 110.046 177.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 31.9 Cg_exo -59.65 140.33 93.11 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.986 2.457 . . . . 0.90000000000000002 112.316 -176.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.88 -34.18 90.84 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.964 3.11 . . . . 0.95999999999999996 112.692 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.56 -39.38 93.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.619 -0.718 . . . . 1.8300000000000001 110.366 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.22 -4.41 50.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.81999999999999995 110.755 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 31.7 mtm180 -98.45 -38.77 9.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.986 -0.552 . . . . 2.1600000000000001 110.162 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -48.78 -42.74 36.74 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.899 0.75 . . . . 1.0600000000000001 111.275 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -56.76 -54.84 41.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.533 -0.758 . . . . 0.65000000000000002 112.132 175.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.588 HD21 ' OH ' ' A' ' 100' ' ' TYR . 65.5 mt -79.53 -10.71 59.85 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.203 0.91 . . . . 1.1299999999999999 111.266 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.26 -45.72 75.83 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.125 0.488 . . . . 2.0600000000000001 110.795 162.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -88.81 -26.48 21.67 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.752 0.649 . . . . 1.8400000000000001 112.752 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.518 HD23 ' CD2' ' A' ' 22' ' ' LEU . 4.8 tp -77.11 136.59 38.63 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-O 121.209 0.528 . . . . 1.05 110.431 -174.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 4.9 p -120.55 -179.18 3.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.525 -0.761 . . . . 1.78 111.738 -171.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.452 ' OD2' ' HG2' ' A' ' 0' ' ' MET . 1.5 m-20 -51.45 -52.17 48.62 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 2.3900000000000001 112.955 -172.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.87 -42.05 78.21 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 116.226 -0.443 . . . . 0.93000000000000005 113.31 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.669 ' O ' HG12 ' A' ' 32' ' ' VAL . 20.8 m-20 -80.86 -36.16 31.75 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.795 -0.238 . . . . 2.25 111.169 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' HD23 ' A' ' 33' ' ' LEU . 96.8 mttt -55.86 -34.03 65.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.325 0.583 . . . . 1.3100000000000001 110.448 177.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.7 m -55.53 -36.56 66.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.01 -0.996 . . . . 0.80000000000000004 112.145 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -88.34 -21.47 6.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 111.978 0.362 . . . . 0.84999999999999998 111.978 -171.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -52.99 -48.06 67.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.681 0.277 . . . . 0.97999999999999998 111.193 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -64.22 -27.68 69.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.338 -0.392 . . . . 2.4100000000000001 111.184 -175.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -68.52 -37.21 79.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.047 0.451 . . . . 1.96 110.052 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 93.4 t -72.62 -48.97 44.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.71 -0.677 . . . . 0.97999999999999998 110.104 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.618 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 32.3 m-85 -57.0 -52.67 64.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.462 1.282 . . . . 0.82999999999999996 114.462 176.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.63 -20.4 59.92 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.286 -0.566 . . . . 2.1800000000000002 111.574 -171.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.64 -74.93 0.21 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.484 -0.325 . . . . 1.5600000000000001 110.255 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.473 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.89 -157.16 1.19 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 121.017 -0.611 . . . . 1.54 112.968 -176.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -95.95 153.58 10.61 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 CA-C-N 118.536 1.168 . . . . 1.6799999999999999 112.001 -7.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 27.7 m-85 -122.3 120.69 34.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 1.28 111.137 -171.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.61 -8.16 54.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.149 -0.932 . . . . 3.5099999999999998 110.554 175.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -160.19 163.81 33.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.018 -0.734 . . . . 1.52 109.018 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.3 m -77.8 -22.77 49.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.776 -0.193 . . . . 1.1799999999999999 111.509 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.83 -36.0 77.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 2.2400000000000002 110.421 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 14.6 mm-40 -57.71 -40.85 80.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.136 0.493 . . . . 2.2599999999999998 110.787 173.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.3 t -70.97 -36.05 72.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.772 -0.649 . . . . 1.1899999999999999 109.846 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.76 -44.87 98.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.286 0.565 . . . . 0.55000000000000004 109.745 176.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.56 -48.7 80.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.021 -0.991 . . . . 0.56999999999999995 111.159 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.55 -40.65 87.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.324 0.583 . . . . 0.5 110.273 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 33' ' ' LEU . 36.5 mt -67.65 -38.24 83.52 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.307 -0.861 . . . . 0.45000000000000001 111.057 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -31.11 72.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.086 0.469 . . . . 1.22 110.995 177.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -75.15 -46.8 31.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 3.0499999999999998 110.946 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -82.79 -37.41 24.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.178 -0.465 . . . . 1.48 112.237 -175.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.7 t -144.49 87.95 7.42 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 109.472 -0.566 . . . . 1.1599999999999999 109.472 176.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -41.42 -60.55 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 124.201 3.268 . . . . 0.57999999999999996 113.9 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.55 -34.53 74.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.117 -0.947 . . . . 2.4500000000000002 111.969 -178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.423 HD22 ' HB3' ' A' ' 29' ' ' ASP . 39.2 tp -68.94 -36.81 78.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.061 -0.718 . . . . 1.4199999999999999 109.061 -175.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.51 -35.34 91.92 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 114.664 -1.153 . . . . 0.37 111.668 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.99 -35.8 69.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.116 0.484 . . . . 0.47999999999999998 110.384 175.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -64.2 -44.26 92.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 2.1699999999999999 111.08 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.5 m -74.71 -30.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.944 -0.302 . . . . 1.1200000000000001 110.765 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.67 -58.89 6.6 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.256 -0.429 . . . . 1.7 110.77 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 69' ' ' MET . 82.7 tttt -57.49 -37.49 73.02 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.476 0.655 . . . . 3.96 110.254 -176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.4 tm? -65.89 -45.69 81.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.02 -0.991 . . . . 1.5 109.958 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -78.3 -30.75 48.52 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.113 -0.699 . . . . 2.3399999999999999 109.113 -172.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.78 -45.51 94.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.155 -0.929 . . . . 0.40000000000000002 111.534 176.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.512 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 53.1 mtm -59.61 -48.36 81.95 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.381 0.61 . . . . 0.71999999999999997 109.873 176.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' LEU . 96.4 t -54.88 -45.53 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 114.915 -1.039 . . . . 0.79000000000000004 110.611 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -63.61 -38.12 89.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 1.47 111.663 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.0 m -61.03 -37.48 82.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.082 0.468 . . . . 1.26 110.791 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.0 mttm -73.47 -48.17 35.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.833 -0.621 . . . . 1.54 110.003 176.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.52 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 81.1 mt -62.08 -20.62 24.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.665 0.745 . . . . 0.34000000000000002 110.678 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.41 -27.81 61.66 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.394 -0.821 . . . . 0.34999999999999998 109.793 177.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.35 0.79 57.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.402 -1.272 . . . . 0.48999999999999999 110.279 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 77' ' ' LEU . 7.6 tp -96.02 140.34 30.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.726 -0.67 . . . . 0.70999999999999996 110.634 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.86 160.21 53.18 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.998 -0.62 . . . . 0.76000000000000001 112.158 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -48.04 -42.96 31.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.929 3.086 . . . . 1.5600000000000001 113.657 -174.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.13 -45.19 74.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.601 -0.272 . . . . 2.52 110.966 -177.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.87 -30.83 40.35 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.002 -0.679 . . . . 0.35999999999999999 110.297 -176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 41.1 ttmt -62.78 -40.72 98.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.625 -0.716 . . . . 2.04 110.704 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.5 -36.93 93.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.878 -0.677 . . . . 0.40999999999999998 111.869 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -68.55 -46.5 69.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.192 . . . . 1.6499999999999999 110.545 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.78 -55.24 36.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.74 0.305 . . . . 0.40999999999999998 111.547 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -84.26 39.46 0.72 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 1.96 110.691 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.547 ' O ' HG13 ' A' ' 91' ' ' ILE . 61.1 tttp -149.51 -43.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.681 -0.69 . . . . 2.1200000000000001 109.285 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.7 p -67.31 -44.2 79.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.335 -0.393 . . . . 0.56999999999999995 110.156 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 61.0 mt -64.06 -32.97 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-N 116.109 -0.496 . . . . 1.0900000000000001 110.183 176.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -60.79 -35.72 77.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.968 0.413 . . . . 2.8199999999999998 110.069 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 87' ' ' LYS . 54.1 mt -72.22 -50.59 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.51000000000000001 110.027 176.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.84 99.77 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.862 -0.608 . . . . 0.64000000000000001 111.484 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.03 -37.08 84.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.749 -0.659 . . . . 4.4199999999999999 110.006 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.38 -31.9 81.01 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 121.096 -0.573 . . . . 0.66000000000000003 111.916 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.8 mm -62.99 -53.54 45.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 0.55000000000000004 110.667 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HD2' HD11 ' A' ' 22' ' ' LEU . 55.7 pttt -84.36 3.44 35.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.204 -0.453 . . . . 2.7000000000000002 110.904 -178.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.618 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -91.5 -34.56 14.74 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.779 -0.452 . . . . 0.63 109.779 170.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 7.3 ptp180 -83.68 -3.59 57.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.261 -0.644 . . . . 3.1000000000000001 109.261 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.2 m-85 -79.33 -34.42 42.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.709 -0.478 . . . . 0.96999999999999997 109.709 164.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.593 ' HD2' ' CE2' ' A' ' 37' ' ' PHE . 22.9 m-85 -67.62 -44.92 76.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.373 0.606 . . . . 1.48 110.642 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.6 p -66.22 -21.93 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.078 -0.964 . . . . 0.87 112.675 -174.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.75 1.03 56.36 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.871 -0.681 . . . . 1.1599999999999999 112.067 -174.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -93.6 56.88 2.46 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.878 0.37 . . . . 1.8300000000000001 110.02 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -55.7 119.36 24.76 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.495 -0.775 . . . . 1.75 111.98 -172.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.498 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 36.8 Cg_endo -67.38 146.81 76.28 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.409 2.739 . . . . 0.53000000000000003 112.543 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -77.32 168.27 20.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.777 -0.453 . . . . 1.48 109.777 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -56.77 -32.65 65.84 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.473 0.654 . . . . 2.8799999999999999 111.163 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -83.28 -14.57 52.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.561 -0.745 . . . . 2.2400000000000002 111.468 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 105' ' ' PRO . 12.2 t70 -68.04 -40.96 82.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.608 -0.515 . . . . 1.73 109.608 174.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -30.75 71.77 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.554 -0.748 . . . . 0.81999999999999995 110.985 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -59.75 -46.55 88.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.607 -0.516 . . . . 1.74 109.607 176.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.067 -0.97 . . . . 0.46999999999999997 110.821 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.454 ' OG ' HG22 ' A' ' 91' ' ' ILE . 33.5 t -53.38 -60.54 3.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 1.3400000000000001 111.478 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.813 HG23 ' HB2' ' A' ' 152' ' ' ALA . 16.2 m -76.19 -24.02 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.014 0.435 . . . . 0.65000000000000002 110.824 -172.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 155' ' ' ASN . 25.3 ttmm -54.94 -45.57 74.86 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.865 -0.607 . . . . 1.72 110.758 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.509 ' O ' HD13 ' A' ' 120' ' ' LEU . 31.7 mt-10 -75.03 -31.99 61.48 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.313 -0.555 . . . . 2.27 111.108 -178.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.3 m -65.29 -32.67 59.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 119.647 -0.821 . . . . 0.81000000000000005 109.92 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 149' ' ' ALA . 83.0 mt -75.35 -36.4 61.0 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.416 . . . . 1.21 109.878 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.406 ' HA ' ' OD1' ' A' ' 155' ' ' ASN . 36.5 ttpt -60.13 -38.09 82.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.467 0.651 . . . . 0.94999999999999996 109.486 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.509 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -78.7 -44.51 23.41 Favored 'General case' 0 N--CA 1.438 -1.025 0 CA-C-N 115.136 -0.938 . . . . 1.0600000000000001 112.073 174.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -72.91 -32.44 65.33 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 119.476 -0.89 . . . . 1.54 111.759 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -66.78 -32.73 74.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.084 0.469 . . . . 1.98 110.632 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.85 -9.52 59.28 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.775 0.657 . . . . 0.69999999999999996 112.775 -174.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.0 mtm -75.07 154.7 37.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.317 -0.553 . . . . 0.5 110.608 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.3 m -64.4 143.72 57.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.11 -0.33 . . . . 1.1799999999999999 110.11 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.68 -45.93 63.63 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.317 0.488 . . . . 2.21 112.317 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.97 -33.34 73.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.89 0.376 . . . . 0.41999999999999998 111.032 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -75.03 -35.24 50.33 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.536 -0.626 . . . . 0.31 111.536 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.65 -43.13 94.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.197 0.522 . . . . 1.3200000000000001 109.617 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.57 -29.86 66.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.53 -0.759 . . . . 0.41999999999999998 111.467 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -75.19 -30.62 60.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.071 0.462 . . . . 0.55000000000000004 109.803 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.413 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.8 t80 -61.65 -27.21 68.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.604 . . . . 0.39000000000000001 110.162 172.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.82 -3.35 73.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.942 -0.646 . . . . 0.27000000000000002 113.052 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -96.54 -39.94 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.481 0.657 . . . . 2.4300000000000002 109.915 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -86.39 -32.42 20.94 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.884 -1.053 . . . . 1.8300000000000001 110.634 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.458 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 53.1 m-85 -136.24 73.1 58.23 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.994 0.426 . . . . 0.68999999999999995 110.951 174.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.99 -36.72 81.41 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.287 2.658 . . . . 0.63 112.942 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 38.2 t80 -61.71 -40.08 93.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.508 -0.314 . . . . 2.3100000000000001 110.878 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -77.37 -43.22 33.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 1.02 110.604 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.07 -40.07 73.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 0.34999999999999998 109.947 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.471 ' HA ' ' HE3' ' A' ' 141' ' ' LYS . 0.0 OUTLIER -44.95 -68.06 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.955 -1.02 . . . . 2.5800000000000001 111.613 173.449 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.508 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.0 OUTLIER -65.0 -22.77 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.229 -0.896 . . . . 0.5 112.132 -174.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -78.99 -38.92 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.191 -0.604 . . . . 0.62 110.739 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 49.6 mt-10 -71.09 -43.85 66.88 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.908 0.385 . . . . 2.5800000000000001 110.316 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.0 m -69.78 -20.0 63.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.742 -0.663 . . . . 1.3200000000000001 111.059 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 86.07 15.34 65.09 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.767 -0.73 . . . . 1.0900000000000001 112.583 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.534 ' CD ' HD21 ' A' ' 13' ' ' LEU . 0.7 OUTLIER -63.02 -42.92 99.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.491 -0.559 . . . . 1.98 109.491 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -69.93 -32.75 71.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.34000000000000002 110.298 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.505 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -60.84 -41.67 96.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.839 -0.618 . . . . 0.51000000000000001 111.052 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -71.38 -8.97 57.26 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.842 0.353 . . . . 2.8199999999999998 111.512 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -93.99 -40.53 10.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.945 0.402 . . . . 0.48999999999999999 109.953 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.813 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.18 -24.59 51.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.823 -0.626 . . . . 0.58999999999999997 112.362 -178.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 93.09 32.84 7.62 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.012 -1.235 . . . . 1.6200000000000001 110.012 -169.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.09 84.21 0.1 Allowed 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.971 0.908 . . . . 4.1200000000000001 110.829 -176.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.628 ' O ' ' HG3' ' A' ' 115' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.848 0 CA-C-N 115.028 -0.987 . . . . 4.0099999999999998 109.483 -174.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.701 0.286 . . . . 23.59 110.91 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 80.79 -102.34 2.12 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 111.156 -0.778 . . . . 22.469999999999999 111.156 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 46.5 m -81.57 93.33 6.68 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.918 0.39 . . . . 21.510000000000002 110.046 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 17.6 m -68.48 -63.67 1.01 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.073 -0.512 . . . . 20.190000000000001 109.839 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 44.25 60.66 2.7 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.06 -0.973 . . . . 21.420000000000002 112.146 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -135.42 139.94 44.53 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.046 -0.724 . . . . 18.199999999999999 109.046 174.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -8' ' ' HIS . . . . . 0.468 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 9.2 p80 -114.11 -27.54 7.63 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.081 0.771 . . . . 16.059999999999999 113.081 -167.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -82.46 20.39 1.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.223 -0.591 . . . . 13.27 111.993 -171.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -99.34 -27.27 13.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.474 -0.33 . . . . 12.33 110.81 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -100.05 121.07 40.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.188 0.518 . . . . 11.33 111.532 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.7 m -158.57 80.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.731 -0.668 . . . . 7.9500000000000002 109.634 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.5 p -94.17 -13.81 26.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.902 0.382 . . . . 7.3600000000000003 111.483 -177.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 156.81 -25.41 0.5 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.604 -0.808 . . . . 4.5700000000000003 111.945 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -87.06 137.63 32.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.856 -0.794 . . . . 4.5199999999999996 108.856 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 1.1 pmm? -78.03 -166.83 0.87 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.495 -0.321 . . . . 2.0 110.985 -176.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -53.73 151.82 5.88 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.364 0.602 . . . . 1.47 111.705 -176.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 71.8 mmtt -111.14 171.88 7.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.712 -0.676 . . . . 3.1499999999999999 109.369 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 75.7 t80 -61.81 -50.44 72.28 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.153 0.502 . . . . 2.3500000000000001 109.971 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.41 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 9.5 pt-20 -74.3 -6.43 47.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 4.1600000000000001 111.883 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.468 ' OD1' ' HB2' ' A' ' -8' ' ' HIS . 11.7 t70 -78.88 -29.61 44.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.294 -0.632 . . . . 2.5699999999999998 109.294 -177.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.8 mt -69.31 135.6 88.9 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.625 -0.716 . . . . 0.68999999999999995 109.093 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -45.46 119.72 2.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.259 2.639 . . . . 0.59999999999999998 112.28 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.24 -18.66 65.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.56999999999999995 112.123 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.68 -33.72 75.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.984 0.897 . . . . 1.3700000000000001 109.251 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -82.61 -29.32 30.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 113.99 -1.459 . . . . 0.80000000000000004 111.26 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 18.5 mtm180 -71.98 -18.08 62.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.455 0.645 . . . . 1.73 109.483 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.61 -27.24 63.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.727 -1.124 . . . . 1.02 110.634 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.479 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 71.8 mt -77.26 -51.54 10.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.976 -0.557 . . . . 0.93000000000000005 111.385 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.447 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 25.3 ptt? -75.3 136.9 71.83 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 1.1499999999999999 111.515 -174.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 31.7 Cg_exo -59.68 159.8 23.16 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.534 2.823 . . . . 0.90000000000000002 112.957 -177.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -53.34 -31.41 56.87 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.55 2.833 . . . . 0.95999999999999996 112.952 -178.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.518 ' O ' HD21 ' A' ' 66' ' ' LEU . 43.8 mt-10 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.816 0.341 . . . . 1.8300000000000001 110.564 177.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -21.32 66.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.319 -0.401 . . . . 0.81999999999999995 111.187 -178.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 11' ' ' ARG . 20.0 mtm180 -88.39 -31.18 18.98 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.955 -0.566 . . . . 2.1600000000000001 110.715 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -52.15 -51.23 59.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.99 -0.55 . . . . 1.0600000000000001 111.262 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.564 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.6 t80 -55.41 -61.56 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.65000000000000002 111.627 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 59.9 mt -74.46 -9.19 58.35 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 119.108 0.867 . . . . 1.1299999999999999 111.944 -176.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -69.35 -40.24 77.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.192 0.52 . . . . 2.0600000000000001 109.989 163.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.88 -47.11 40.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.446 -0.797 . . . . 1.8400000000000001 111.074 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.612 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.9 mm? -59.85 141.54 55.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.4 0.619 . . . . 1.05 111.202 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.6 t -116.14 -63.76 1.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.78 110.314 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -176.02 -47.83 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.134 0.271 . . . . 2.3900000000000001 111.432 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.61 -34.64 79.1 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.519 -0.848 . . . . 0.93000000000000005 111.305 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -36.93 69.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 2.25 109.946 173.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 88.5 mttt -61.64 -26.88 68.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.329 -0.85 . . . . 1.3100000000000001 111.61 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 21.7 m -64.64 -35.67 81.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 0.80000000000000004 110.35 177.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.6 t -66.27 -41.03 88.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.84999999999999998 110.715 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.582 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.4 mm? -56.77 -46.27 81.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.915 0.388 . . . . 0.97999999999999998 110.417 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -55.88 -43.21 76.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 2.4100000000000001 111.681 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 31' ' ' THR . 40.4 mm-40 -69.86 -33.2 71.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 1.96 111.407 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 67.6 t -75.59 -51.27 21.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.97999999999999998 110.8 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.427 ' HB3' ' CG2' ' A' ' 101' ' ' THR . 14.6 m-85 -48.14 -50.61 28.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.791 1.034 . . . . 0.82999999999999996 113.791 174.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -73.73 -25.55 60.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.115 -0.634 . . . . 2.1800000000000002 111.571 -175.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.56 -79.16 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.17 -0.308 . . . . 1.5600000000000001 110.17 174.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.538 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.43 -148.23 3.41 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.749 -0.739 . . . . 1.54 112.395 -173.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.458 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.5 149.82 12.9 Favored 'Cis proline' 0 N--CA 1.454 -0.813 0 CA-C-N 118.734 1.267 . . . . 1.6799999999999999 111.116 -8.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.538 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 18.0 m-85 -118.44 128.12 54.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.485 0.659 . . . . 1.28 111.62 -170.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -86.89 -15.15 39.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.67 -1.15 . . . . 3.5099999999999998 108.314 175.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 47' ' ' GLU . 7.3 p30 -150.71 150.52 31.16 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.079 -1.082 . . . . 1.52 108.079 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.562 HG21 ' NE2' ' A' ' 67' ' ' HIS . 4.7 m -77.04 -16.12 59.38 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.87 -0.332 . . . . 1.1799999999999999 111.694 -171.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -62.45 -26.88 68.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 2.2400000000000002 110.21 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.7 mt-10 -65.09 -41.37 95.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 2.2599999999999998 110.583 173.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 41.2 t -69.17 -41.46 77.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.143 0.496 . . . . 1.1899999999999999 110.046 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 98.0 mt -61.01 -44.33 97.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.674 -0.694 . . . . 0.55000000000000004 110.057 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -51.42 69.54 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 0.56999999999999995 111.661 174.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -56.93 -43.16 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.5 110.718 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.56 HD21 HD13 ' A' ' 33' ' ' LEU . 45.9 mt -68.36 -34.03 75.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.298 -0.864 . . . . 0.45000000000000001 111.241 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.09 -28.52 68.25 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.739 0.304 . . . . 1.22 111.222 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -76.52 -45.13 32.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.035 0.445 . . . . 3.0499999999999998 110.739 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 31.1 mmmt -67.27 -46.77 72.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.865 -0.607 . . . . 1.48 111.149 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.447 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 22.9 t -149.5 102.18 3.29 Favored Pre-proline 0 C--N 1.315 -0.919 0 C-N-CA 120.818 -0.353 . . . . 1.1599999999999999 110.327 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 4.4 Cg_endo -47.09 -59.62 1.18 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 123.581 2.854 . . . . 0.57999999999999996 113.346 -168.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.16 -28.04 66.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.578 -0.737 . . . . 2.4500000000000002 111.283 -177.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -40.36 81.47 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.241 -1.022 . . . . 1.4199999999999999 108.241 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.81 -23.08 65.08 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.365 -1.289 . . . . 0.37 112.156 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.72 -31.1 66.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.867 0.365 . . . . 0.47999999999999998 110.733 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.63 -47.23 76.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.289 -0.414 . . . . 2.1699999999999999 110.539 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.39 -29.0 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 1.1200000000000001 110.736 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 4.9 tm-20 -60.79 -55.17 36.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.692 -0.686 . . . . 1.7 110.239 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.5 ptmm? -62.52 -30.28 71.17 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-O 121.148 0.499 . . . . 3.96 109.911 -176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.49 -1.45 15.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.514 -0.766 . . . . 1.5 111.274 -176.547 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.632 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 67.5 m80 -118.88 -46.79 2.53 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.241 -0.436 . . . . 2.3399999999999999 110.821 175.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.42 -43.41 83.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.612 0.227 . . . . 0.40000000000000002 111.612 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 33.8 mtm -61.2 -41.34 96.66 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.474 0.654 . . . . 0.71999999999999997 110.237 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.0 t -71.39 -40.41 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.211 -0.904 . . . . 0.79000000000000004 110.76 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 30.4 mmmt -60.55 -34.93 74.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.735 -0.666 . . . . 1.47 111.018 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.3 m -60.2 -33.0 71.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.289 0.566 . . . . 1.26 111.135 177.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.432 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.2 mttp -82.24 -42.59 18.7 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.562 -0.744 . . . . 1.54 110.194 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -69.6 -24.07 26.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.213 0.53 . . . . 0.34000000000000002 111.055 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.0 -26.82 64.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.945 0.879 . . . . 0.34999999999999998 109.558 174.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.34 2.5 55.82 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.32 -1.309 . . . . 0.48999999999999999 110.101 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 132' ' ' PHE . 12.1 tp -96.44 136.35 37.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.533 -0.758 . . . . 0.70999999999999996 109.958 -175.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.5 153.05 51.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.592 -0.813 . . . . 0.76000000000000001 112.32 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -42.53 -41.31 7.91 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 124.558 3.505 . . . . 1.5600000000000001 113.518 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -64.01 -49.52 72.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.948 -0.569 . . . . 2.52 110.787 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.535 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.05 -31.91 34.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.904 -0.589 . . . . 0.35999999999999999 110.664 -176.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -56.02 -48.03 76.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 2.04 110.881 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.04 -40.0 94.99 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.819 -0.705 . . . . 0.40999999999999998 111.917 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 121' ' ' TYR . 4.9 t80 -69.37 -44.23 71.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.74 -0.23 . . . . 1.6499999999999999 111.08 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.38 -49.72 76.24 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.089 0.471 . . . . 0.40999999999999998 111.047 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -67.32 -14.23 62.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.611 -0.722 . . . . 1.96 111.058 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -94.53 -46.5 6.95 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.476 -0.329 . . . . 2.1200000000000001 110.691 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 p -65.25 -34.22 77.83 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.321 -0.4 . . . . 0.56999999999999995 110.728 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.441 HG23 ' NH1' ' A' ' 93' ' ' ARG . 17.7 mt -55.77 -46.05 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 115.979 -0.555 . . . . 1.0900000000000001 110.745 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.775 0.322 . . . . 2.8199999999999998 110.989 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.63 -51.81 47.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.51000000000000001 110.351 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.12 68.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.64000000000000001 110.934 -178.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' A' ' 66' ' ' LEU . 4.4 mpt_? -69.7 -32.79 71.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.938 -0.574 . . . . 4.4199999999999999 110.28 173.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -65.61 -38.73 94.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.155 -0.545 . . . . 0.66000000000000003 112.081 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.425 HD11 ' CB ' ' A' ' 113' ' ' SER . 38.9 mm -56.64 -51.04 71.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.26 0.552 . . . . 0.55000000000000004 110.129 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.2 mppt? -93.8 28.64 2.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.807 -0.633 . . . . 2.7000000000000002 110.181 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -108.1 -33.66 7.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.457 -0.942 . . . . 0.63 108.457 164.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.672 ' HB2' ' ND2' ' A' ' 103' ' ' ASN . 5.2 ptp180 -86.17 -9.65 56.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.543 -0.753 . . . . 3.1000000000000001 109.995 175.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 12.9 m-85 -77.38 -29.97 53.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.112 -0.699 . . . . 0.96999999999999997 109.112 163.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' ' HG ' ' A' ' 25' ' ' LEU . 2.5 m-85 -83.94 -52.77 6.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.515 -0.766 . . . . 1.48 111.994 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 10.5 p -59.12 -26.3 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.299 0.852 . . . . 0.87 113.299 -173.012 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 108.89 39.31 1.73 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.699 -0.762 . . . . 1.1599999999999999 113.608 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.672 ' ND2' ' HB2' ' A' ' 98' ' ' ARG . 4.2 p-10 -149.08 68.8 1.05 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.33 0.586 . . . . 1.8300000000000001 109.995 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -45.12 125.89 5.53 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 114.834 -1.075 . . . . 1.75 111.944 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.48 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 58.1 Cg_endo -74.19 155.35 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.989 2.459 . . . . 0.53000000000000003 111.937 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 171.63 8.96 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.145 -0.687 . . . . 1.48 109.145 173.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -62.01 -29.8 70.51 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.388 -0.525 . . . . 2.8799999999999999 110.646 -176.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.36 -31.31 72.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.879 -0.6 . . . . 2.2400000000000002 110.863 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.99 -46.81 70.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.375 -0.375 . . . . 1.73 110.292 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.597 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.0 mp -63.81 -43.1 97.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.81999999999999995 110.031 176.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 151' ' ' PHE . 41.8 tttp -52.6 -53.29 48.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.651 -0.704 . . . . 1.74 110.528 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -62.65 -39.25 93.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.284 -0.871 . . . . 0.46999999999999997 111.592 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.425 ' CB ' HD11 ' A' ' 95' ' ' ILE . 49.4 m -67.48 -44.5 78.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.841 0.682 . . . . 1.3400000000000001 112.841 -178.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.597 HG13 ' O ' ' A' ' 110' ' ' LEU . 2.9 m -71.27 -28.38 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 N-CA-C 108.607 -0.886 . . . . 0.65000000000000002 108.607 -179.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 84.4 tttt -53.62 -39.17 64.71 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.295 . . . . 1.72 111.25 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.566 ' O ' HD13 ' A' ' 120' ' ' LEU . 25.3 mt-10 -73.72 -36.82 65.24 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 120.113 -0.635 . . . . 2.27 111.322 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.8 m -64.77 -31.92 55.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 C-N-CA 119.98 -0.688 . . . . 0.81000000000000005 110.459 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.47 HD23 ' HE2' ' A' ' 122' ' ' LYS . 6.8 mp -80.05 -31.76 39.45 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.768 -0.583 . . . . 1.21 110.483 172.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -55.12 -42.7 73.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.852 0.834 . . . . 0.94999999999999996 109.369 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -77.37 -47.02 20.97 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.45 -1.25 . . . . 1.0600000000000001 112.11 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.456 ' HB2' ' CE2' ' A' ' 84' ' ' PHE . 20.6 t80 -70.33 -33.75 71.85 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 119.61 -0.836 . . . . 1.54 111.775 -170.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.47 ' HE2' HD23 ' A' ' 118' ' ' LEU . 68.1 mttm -66.82 -30.6 70.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 1.98 111.174 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -84.84 -7.27 59.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.756 -0.656 . . . . 0.69999999999999996 112.604 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.535 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 58.7 mtm -74.53 158.44 33.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.506 -0.478 . . . . 0.5 110.951 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 7.3 m -65.07 145.72 55.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.45 -0.341 . . . . 1.1799999999999999 110.282 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.75 -47.25 70.84 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.01 0.374 . . . . 2.21 112.01 -173.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.86 -27.46 69.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.41999999999999998 110.992 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.48 -34.22 29.29 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.743 -0.543 . . . . 0.31 111.743 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -66.78 -45.04 79.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 1.3200000000000001 109.98 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 134' ' ' LYS . . . -68.7 -26.44 65.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.367 -0.833 . . . . 0.41999999999999998 110.691 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.458 ' OD2' HD12 ' A' ' 77' ' ' LEU . 24.6 t70 -78.28 -29.28 47.87 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.209 -0.663 . . . . 0.55000000000000004 109.209 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.496 ' HA ' HD11 ' A' ' 77' ' ' LEU . 84.2 t80 -66.4 -34.05 77.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 0.39000000000000001 110.189 173.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.31 -13.96 65.79 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.933 -0.651 . . . . 0.27000000000000002 112.704 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 130' ' ' ALA . 58.2 mttm -91.17 -16.69 27.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.224 0.535 . . . . 2.4300000000000002 110.529 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.432 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 57.2 mm-40 -110.87 -35.92 5.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.617 -0.72 . . . . 1.8300000000000001 110.27 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -122.68 76.41 47.01 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.589 -0.523 . . . . 0.68999999999999995 109.589 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.14 -30.32 46.86 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.828 2.352 . . . . 0.63 113.074 -172.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.604 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 11.9 m-85 -77.76 -36.06 51.07 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.186 0.439 . . . . 2.3100000000000001 112.186 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.3 mt -71.81 -47.53 52.67 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 119.904 -0.718 . . . . 1.02 109.716 177.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.42 72.63 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.054 0.454 . . . . 0.34999999999999998 110.051 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 84.1 tttt -50.25 -73.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.272 -0.876 . . . . 2.5800000000000001 111.19 171.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.7 m -65.39 -25.54 37.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.336 -0.847 . . . . 0.5 112.667 -172.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 20.0 m-30 -69.5 -50.79 41.89 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.557 -0.457 . . . . 0.62 110.606 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.7 -28.75 64.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 2.5800000000000001 111.425 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.1 m -76.56 -9.45 58.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.02 0.438 . . . . 1.3200000000000001 110.729 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 78.56 17.65 77.21 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 121.128 -0.558 . . . . 1.0900000000000001 112.621 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.479 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 0.8 OUTLIER -74.27 -51.73 14.43 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.407 -0.59 . . . . 1.98 109.407 -178.667 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.6 -33.85 76.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.132 0.492 . . . . 0.34000000000000002 110.166 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -60.58 -35.6 76.47 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.51000000000000001 110.781 176.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -73.23 -34.65 66.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.046 0.45 . . . . 2.8199999999999998 110.483 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.485 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 38.1 t80 -63.56 -45.11 92.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 0.48999999999999999 109.705 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -75.07 -22.24 58.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.858 -0.61 . . . . 0.58999999999999997 111.519 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 116.88 -73.45 0.28 Allowed Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.282 -1.127 . . . . 1.6200000000000001 110.282 -175.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -176.79 67.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.136 -1.061 . . . . 4.1200000000000001 108.136 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.451 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 58.6 t30 . . . . . 0 C--O 1.246 0.884 0 CA-C-N 114.016 -1.447 . . . . 4.0099999999999998 111.494 -171.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 110.019 -0.363 . . . . 23.59 110.019 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 76.06 -98.38 1.21 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.743 -0.741 . . . . 22.469999999999999 111.997 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 9.3 t -89.17 56.59 3.72 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.261 0.553 . . . . 21.510000000000002 109.788 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 15.5 m -122.61 47.78 1.88 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 20.190000000000001 110.369 -179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -79.4 93.77 5.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.926 -0.579 . . . . 21.420000000000002 109.517 178.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -70.1 105.38 2.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.967 -0.56 . . . . 18.199999999999999 112.054 -173.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -81.87 86.99 6.41 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.855 -0.795 . . . . 16.059999999999999 108.855 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -68.59 140.38 55.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.725 -0.671 . . . . 13.27 111.712 -171.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 68.26 166.15 0.25 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.473 -0.785 . . . . 12.33 112.203 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -75.2 90.08 2.55 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.505 -0.77 . . . . 11.33 110.057 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 47.0 t 63.83 70.13 0.52 Allowed 'General case' 0 C--N 1.33 -0.266 0 O-C-N 123.733 0.646 . . . . 7.9500000000000002 110.743 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 38.0 t -73.53 -33.72 64.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.957 -0.757 . . . . 7.3600000000000003 108.957 174.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -124.13 -92.21 0.98 Allowed Glycine 0 N--CA 1.44 -1.039 0 CA-C-N 115.114 -0.948 . . . . 4.5700000000000003 111.127 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 6.1 t60 57.71 42.78 23.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.386 0.612 . . . . 4.5199999999999996 109.68 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 11.0 tpt -138.82 110.82 7.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.761 -0.654 . . . . 2.0 110.186 -178.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.706 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 67.8 t80 -68.59 131.34 45.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.944 -0.571 . . . . 1.47 110.908 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 28.8 mtmm -120.86 -83.15 0.66 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.283 -0.417 . . . . 3.1499999999999999 111.018 174.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 47.4 t80 167.25 -42.74 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.669 -0.863 . . . . 2.3500000000000001 108.669 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 52.7 mt-10 -66.49 -18.88 65.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.932 -1.031 . . . . 4.1600000000000001 110.685 175.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.75 -5.34 57.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.522 . . . . 2.5699999999999998 111.193 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 1' ' ' PHE . 44.7 mt -80.84 137.16 50.53 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 108.702 -0.851 . . . . 0.68999999999999995 108.702 174.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -46.9 115.39 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.709 2.272 . . . . 0.59999999999999998 111.716 176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.86 -20.55 65.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.043 -0.526 . . . . 0.56999999999999995 111.209 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.03 -35.92 82.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.648 0.737 . . . . 1.3700000000000001 110.097 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -83.66 -29.16 27.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.688 -1.142 . . . . 0.80000000000000004 111.414 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 20.9 mtm180 -69.23 -20.85 63.96 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.508 0.671 . . . . 1.73 109.427 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -68.16 -15.14 63.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.597 -1.183 . . . . 1.02 110.473 175.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.3 mt -104.27 -0.46 28.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.93000000000000005 110.827 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.5 mtt -81.67 130.32 61.82 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.605 -0.271 . . . . 1.1499999999999999 111.281 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -56.43 138.59 84.65 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.731 2.287 . . . . 0.90000000000000002 111.505 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.417 ' HD3' ' CG ' ' A' ' 138' ' ' PHE . 18.7 Cg_endo -59.26 -29.37 90.15 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.53 2.82 . . . . 0.95999999999999996 112.79 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -70.48 -49.08 52.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.233 -0.44 . . . . 1.8300000000000001 110.083 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.9 71.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 0.81999999999999995 110.956 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -67.87 -40.64 83.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 2.1600000000000001 111.022 177.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -52.88 -46.03 67.76 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.397 0.436 . . . . 1.0600000000000001 111.278 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.635 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 30.9 t80 -57.74 -61.0 2.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 0.65000000000000002 111.265 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 25' ' ' LEU . 8.2 mp -72.69 -8.25 54.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.994 0.816 . . . . 1.1299999999999999 112.261 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -70.68 -57.35 4.78 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.852 0.358 . . . . 2.0600000000000001 110.986 163.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.22 -37.07 33.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.036 -0.529 . . . . 1.8400000000000001 111.905 -171.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.72 ' CD1' ' HB2' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -63.89 137.19 57.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 109.653 -0.499 . . . . 1.05 109.653 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.7 p -123.95 179.37 4.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.456 -0.338 . . . . 1.78 111.77 -170.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -56.45 -41.06 75.86 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.845 0.683 . . . . 2.3900000000000001 112.845 -171.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.16 -34.06 82.49 Favored Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.727 -0.749 . . . . 0.93000000000000005 112.481 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.72 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -85.0 -33.82 22.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.979 0.419 . . . . 2.25 109.887 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HG3' HD11 ' A' ' 25' ' ' LEU . 87.0 mttt -66.98 -10.8 53.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.557 0.694 . . . . 1.3100000000000001 109.99 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 90.6 m -74.2 -31.94 62.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.871 -1.059 . . . . 0.80000000000000004 110.486 174.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.642 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 10.2 p -87.14 -28.82 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 120.671 -0.411 . . . . 0.84999999999999998 110.913 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.402 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.3 mm? -52.19 -48.7 64.89 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.348 0.118 . . . . 0.97999999999999998 111.182 174.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -63.84 -34.18 77.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.767 0.318 . . . . 2.4100000000000001 111.438 -178.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -68.9 -39.61 79.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.375 -0.375 . . . . 1.96 110.84 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.98 -43.81 38.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-O 121.177 0.513 . . . . 0.97999999999999998 111.103 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.402 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 20.0 m-85 -60.2 -33.74 72.66 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 113.661 0.986 . . . . 0.82999999999999996 113.661 174.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -92.52 9.39 34.71 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.656 -0.818 . . . . 2.1800000000000002 110.547 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -101.97 -78.9 0.53 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.334 -0.848 . . . . 1.5600000000000001 108.887 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.532 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.59 -151.35 3.03 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.85 -0.691 . . . . 1.54 112.808 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.29 130.92 5.83 Favored 'Cis proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.163 -1.182 . . . . 1.6799999999999999 110.916 -9.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.532 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 19.5 m-85 -105.55 120.29 41.27 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.438 -0.801 . . . . 1.28 111.31 -170.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -73.14 -16.86 61.44 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.089 -0.96 . . . . 3.5099999999999998 110.212 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.425 HD21 ' HG3' ' A' ' 47' ' ' GLU . 6.9 p30 -144.39 174.54 10.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.233 -0.439 . . . . 1.52 110.17 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.7 m -75.89 -37.05 59.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 1.1799999999999999 111.165 -177.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -60.16 -35.24 74.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.023 -0.535 . . . . 2.2400000000000002 112.321 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.8 mt-10 -61.28 -36.63 80.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.895 0.378 . . . . 2.2599999999999998 110.985 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 30.0 t -74.34 -34.91 63.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.853 -0.425 . . . . 1.1899999999999999 109.853 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.6 mt -62.92 -42.26 95.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.561 0.696 . . . . 0.55000000000000004 109.6 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.85 76.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.667 -1.151 . . . . 0.56999999999999995 111.802 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.05 79.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.087 -0.506 . . . . 0.5 110.896 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.99 -40.32 83.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 0.45000000000000001 110.855 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -62.38 -34.71 77.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.692 0.282 . . . . 1.22 111.657 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -66.23 -44.48 83.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.437 . . . . 3.0499999999999998 110.84 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.642 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 8.5 tppt? -77.11 -56.32 4.67 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.937 0.398 . . . . 1.48 110.543 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 52.3 m -125.34 103.99 28.9 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-O 121.51 0.671 . . . . 1.1599999999999999 109.992 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 19.7 Cg_endo -58.63 -56.21 1.63 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.635 2.89 . . . . 0.57999999999999996 113.361 -170.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 48.6 mm-40 -73.88 -24.27 59.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.802 -0.636 . . . . 2.4500000000000002 111.084 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.552 ' HG ' ' HB3' ' A' ' 29' ' ' ASP . 0.9 OUTLIER -71.05 -42.92 68.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.813 -0.81 . . . . 1.4199999999999999 108.813 -178.078 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.62 -24.36 76.95 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.392 -1.276 . . . . 0.37 111.619 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.02 74.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.809 0.337 . . . . 0.47999999999999998 110.82 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 66.9 mttm -60.56 -54.7 42.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.956 -0.565 . . . . 2.1699999999999999 110.72 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.78 -30.21 49.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 1.1200000000000001 110.958 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -61.36 -60.37 3.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.279 -0.419 . . . . 1.7 111.164 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.527 ' O ' ' HG3' ' A' ' 69' ' ' MET . 91.5 mttt -62.52 -33.2 74.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 3.96 110.345 -176.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.61 HD22 ' HB2' ' A' ' 21' ' ' PHE . 34.2 tp -64.9 -41.3 95.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.352 -0.84 . . . . 1.5 110.602 176.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -72.66 -32.09 65.59 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.955 -0.757 . . . . 2.3399999999999999 108.955 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.53 -36.02 76.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.409 -1.269 . . . . 0.40000000000000002 111.526 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 44.2 mtm -65.59 -51.28 60.93 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.262 0.553 . . . . 0.71999999999999997 110.137 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.47 -39.68 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.312 -0.858 . . . . 0.79000000000000004 110.094 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tpmt? -60.06 -40.39 89.3 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.615 -0.721 . . . . 1.47 110.439 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -61.64 -38.13 86.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.05 0.452 . . . . 1.26 110.685 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -75.55 -47.19 27.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.052 -0.522 . . . . 1.54 110.341 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 73.2 mt -63.2 -20.96 27.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.586 0.708 . . . . 0.34000000000000002 110.388 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.29 -30.73 63.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.2 -0.909 . . . . 0.34999999999999998 110.005 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.1 -3.2 58.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.44 -1.254 . . . . 0.48999999999999999 110.008 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.3 tp -91.95 130.54 37.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.241 -0.89 . . . . 0.70999999999999996 109.596 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.91 155.25 50.65 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.84 -0.695 . . . . 0.76000000000000001 111.741 -178.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -44.37 -40.19 12.96 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.659 2.906 . . . . 1.5600000000000001 114.073 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -62.46 -41.21 98.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 2.52 111.012 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.416 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -92.93 -32.42 14.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.144 0.497 . . . . 0.35999999999999999 111.038 -177.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.0 ttpt -60.31 -39.5 87.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.615 -0.721 . . . . 2.04 111.305 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.05 -44.02 98.35 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.473 -0.87 . . . . 0.40999999999999998 111.727 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -67.67 -45.57 74.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.247 . . . . 1.6499999999999999 111.422 178.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.763 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -52.32 -60.21 3.49 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.239 0.337 . . . . 0.40999999999999998 111.469 -176.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 32.3 mt-10 -62.4 -36.14 81.4 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.823 -0.351 . . . . 1.96 110.973 -174.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -70.5 -41.84 72.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.278 -0.419 . . . . 2.1200000000000001 110.974 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.3 p -69.68 -32.48 71.12 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.936 -0.306 . . . . 0.56999999999999995 110.515 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.763 HG12 ' O ' ' A' ' 85' ' ' ALA . 46.2 mm -59.51 -39.06 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.787 -0.449 . . . . 1.0900000000000001 109.787 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.628 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 52.3 mt-10 -60.48 -43.07 97.35 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.343 -0.389 . . . . 2.8199999999999998 110.47 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.2 mt -65.63 -46.06 90.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.51000000000000001 111.05 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -31.59 71.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.225 0.535 . . . . 0.64000000000000001 110.421 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.488 ' NH2' ' HG2' ' A' ' 90' ' ' GLU . 43.2 mtm180 -69.84 -35.98 75.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.871 -0.604 . . . . 4.4199999999999999 110.457 174.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.3 98.22 Favored Glycine 0 N--CA 1.451 -0.325 0 O-C-N 123.325 0.391 . . . . 0.66000000000000003 113.005 -176.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.9 mm -59.01 -49.07 84.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.202 0.525 . . . . 0.55000000000000004 110.533 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 20.6 pttp -81.29 -7.71 59.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.866 -0.606 . . . . 2.7000000000000002 111.232 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -77.34 -39.88 46.05 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.3 0.571 . . . . 0.63 109.983 174.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -86.92 10.03 17.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.613 -0.721 . . . . 3.1000000000000001 109.645 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.706 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.4 m-85 -98.43 -40.23 8.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.574 -0.739 . . . . 0.96999999999999997 110.017 162.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -55.35 -38.99 69.49 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.168 0.509 . . . . 1.48 111.251 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.7 p -70.66 -1.97 12.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.272 -0.876 . . . . 0.87 112.817 -173.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.7 2.31 75.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.626 -0.797 . . . . 1.1599999999999999 111.345 -175.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -90.53 169.93 10.62 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.035 -0.728 . . . . 1.8300000000000001 109.035 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.1 mt-10 -142.59 106.09 5.46 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.582 0.23 . . . . 1.75 110.751 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.567 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 23.0 Cg_endo -64.74 141.09 70.62 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.434 2.09 . . . . 0.53000000000000003 111.304 174.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.4 t -72.56 161.26 31.02 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.055 -0.72 . . . . 1.48 109.055 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -19.63 63.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.818 0.342 . . . . 2.8799999999999999 111.145 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.21 -40.92 86.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.254 -0.43 . . . . 2.2400000000000002 110.185 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -58.27 -41.48 84.42 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.43 0.633 . . . . 1.73 110.243 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.53 ' O ' HG23 ' A' ' 114' ' ' VAL . 11.0 mp -64.49 -50.75 66.21 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.92 -1.036 . . . . 0.81999999999999995 110.42 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -53.51 -52.82 58.38 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.404 -0.362 . . . . 1.74 110.951 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.72 86.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.912 -0.585 . . . . 0.46999999999999997 111.321 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 117' ' ' VAL . 68.6 m -66.74 -39.02 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.284 -0.416 . . . . 1.3400000000000001 111.586 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 110' ' ' LEU . 48.8 t -77.93 -37.54 23.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.551 0.691 . . . . 0.65000000000000002 109.377 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 154' ' ' GLU . 22.2 ttmm -54.24 -39.83 67.15 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.792 -1.095 . . . . 1.72 110.727 173.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.52 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.6 tt0 -74.28 -32.4 62.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 116.569 -0.287 . . . . 2.27 110.385 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 113' ' ' SER . 99.3 t -59.21 -45.22 93.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.255 0.55 . . . . 0.81000000000000005 110.358 172.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.25 -28.0 65.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.614 -0.721 . . . . 1.21 110.096 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.508 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 33.3 ttpt -61.21 -42.23 98.23 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.822 -0.807 . . . . 0.94999999999999996 108.822 177.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.3 mp -71.87 -51.69 21.07 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.188 -0.915 . . . . 1.0600000000000001 111.374 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.616 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -69.89 -36.92 75.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 119.223 -0.991 . . . . 1.54 111.862 -167.243 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -64.6 -30.27 71.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.826 0.346 . . . . 1.98 111.146 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.15 -4.85 59.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.506 0.558 . . . . 0.69999999999999996 112.506 -176.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.502 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 55.8 mtm -75.45 161.34 29.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.5 -0.48 . . . . 0.5 111.771 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.8 m -59.67 144.15 48.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.784 -0.644 . . . . 1.1799999999999999 109.785 170.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.98 -40.79 94.79 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.555 0.217 . . . . 2.21 111.378 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.34 -29.6 70.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.41999999999999998 110.636 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.28 -37.56 63.17 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.446 -0.662 . . . . 0.31 111.446 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.616 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 97.1 mttt -65.76 -46.89 77.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.261 0.553 . . . . 1.3200000000000001 109.902 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.36 -35.56 81.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.414 -0.812 . . . . 0.41999999999999998 111.472 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -76.04 -33.59 59.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.002 0.429 . . . . 0.55000000000000004 110.006 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.705 -0.679 . . . . 0.39000000000000001 110.146 172.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.56 -6.31 70.69 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 116.013 -0.54 . . . . 0.27000000000000002 113.451 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -95.53 -50.55 4.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.226 0.536 . . . . 2.4300000000000002 110.143 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.409 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -81.01 -20.92 40.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.2 -0.909 . . . . 1.8300000000000001 111.168 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -137.3 69.99 54.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.764 0.316 . . . . 0.68999999999999995 111.102 174.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.17 -42.17 59.71 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.173 2.582 . . . . 0.63 113.067 -178.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.511 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 30.7 t80 -61.87 -46.73 88.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.404 -0.362 . . . . 2.3100000000000001 111.37 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 80.7 mt -72.45 -43.09 64.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.023 -0.271 . . . . 1.02 110.911 -177.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.86 -39.42 77.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.762 0.315 . . . . 0.34999999999999998 110.225 177.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.511 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 38.9 ttpt -47.27 -66.49 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 2.5800000000000001 111.115 173.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.4 ' HA ' ' HB3' ' A' ' 147' ' ' LYS . 3.3 m -64.78 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.515 -0.766 . . . . 0.5 112.824 -174.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.511 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 21.6 m-85 -76.14 -48.99 18.52 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.847 -0.741 . . . . 0.62 110.68 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -66.24 -38.7 88.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.4 -0.363 . . . . 2.5800000000000001 111.151 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 13.5 m -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 1.3200000000000001 111.806 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 83.62 12.46 77.84 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.692 -0.766 . . . . 1.0900000000000001 112.574 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 142' ' ' VAL . 9.7 tppt? -61.5 -53.85 50.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 1.98 110.647 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.15 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 0.34000000000000002 110.657 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.66 85.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.841 -0.618 . . . . 0.51000000000000001 111.071 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 41.9 mmtm -69.95 -21.07 63.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.086 0.469 . . . . 2.8199999999999998 110.629 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -91.71 -39.71 11.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.758 -0.656 . . . . 0.48999999999999999 110.616 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.412 ' HB2' ' HB ' ' A' ' 114' ' ' VAL . . . -85.94 -4.07 59.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.58999999999999997 112.278 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 70.13 27.43 72.94 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.926 -0.87 . . . . 1.6200000000000001 110.926 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 115' ' ' LYS . 30.4 tt0 66.39 170.88 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.765 0.826 . . . . 4.1200000000000001 110.832 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 30.2 t30 . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.512 -0.756 . . . . 4.0099999999999998 109.611 176.198 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -14' ' ' MET . . . . . 0.506 ' SD ' ' HB3' ' A' ' 26' ' ' SER . 94.6 mmm . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 110.289 -0.263 . . . . 23.59 110.289 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 87.03 44.93 5.54 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 22.469999999999999 111.751 -178.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 10.0 m -80.12 78.23 6.79 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 122.135 0.174 . . . . 21.510000000000002 110.908 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 43.8 t 68.9 -60.99 0.43 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.536 0.735 . . . . 20.190000000000001 111.742 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 26.4 m170 -102.83 110.02 21.79 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.685 -0.487 . . . . 21.420000000000002 109.685 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -114.67 74.8 0.89 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.776 0.798 . . . . 18.199999999999999 110.717 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -134.45 -158.51 0.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.059 -0.973 . . . . 16.059999999999999 108.735 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -76.45 -38.22 55.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.014 -0.735 . . . . 13.27 109.014 173.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 55.9 27.17 10.67 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.829 -1.078 . . . . 12.33 112.405 166.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 57.84 77.61 0.27 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.132 -0.485 . . . . 11.33 110.868 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.9 m -57.21 135.82 56.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.169 -0.469 . . . . 7.9500000000000002 110.256 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 18.8 m -90.49 35.26 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.368 -0.378 . . . . 7.3600000000000003 111.427 -175.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 75.7 -78.01 1.22 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.129 -0.558 . . . . 4.5700000000000003 112.302 178.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -129.39 134.77 48.03 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.852 -0.425 . . . . 4.5199999999999996 109.852 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.464 ' HG3' ' OD1' ' A' ' 27' ' ' ASP . 95.8 mmm -130.88 143.69 50.92 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.682 -0.488 . . . . 2.0 109.682 179.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -75.71 149.73 38.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.985 0.421 . . . . 1.47 110.467 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -123.77 153.39 41.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.534 -0.543 . . . . 3.1499999999999999 109.534 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -54.45 -45.32 73.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.281 0.562 . . . . 2.3500000000000001 109.576 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -61.93 -27.7 69.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.148 -0.933 . . . . 4.1600000000000001 112.064 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -79.44 -23.21 43.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.091 0.472 . . . . 2.5699999999999998 110.329 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.44 133.71 84.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.184 -0.673 . . . . 0.68999999999999995 109.184 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -44.25 110.46 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.14 2.56 . . . . 0.59999999999999998 112.249 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.78 -21.84 66.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.493 -0.776 . . . . 0.56999999999999995 112.209 -171.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.42 -35.42 80.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.332 0.587 . . . . 1.3700000000000001 110.316 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 14' ' ' MET . 37.5 t80 -84.42 -29.4 26.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.09 -0.959 . . . . 0.80000000000000004 110.956 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.62 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 11.9 mtm180 -65.95 -27.15 67.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.703 0.764 . . . . 1.73 109.059 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.41 -24.67 66.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.469 -1.241 . . . . 1.02 110.24 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.547 HD21 ' HG3' ' A' ' 147' ' ' LYS . 9.9 mt -97.55 1.78 49.33 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.639 -0.709 . . . . 0.93000000000000005 110.191 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 96.0 mtp -96.47 137.37 21.54 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.153 -0.476 . . . . 1.1499999999999999 110.071 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.06 142.03 95.94 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.626 2.217 . . . . 0.90000000000000002 111.678 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.69 -19.07 51.58 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.464 2.776 . . . . 0.95999999999999996 112.472 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 66' ' ' LEU . 4.0 mm-40 -62.57 -55.25 29.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.598 -0.728 . . . . 1.8300000000000001 109.616 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.87 -28.6 65.78 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.482 -0.781 . . . . 0.81999999999999995 111.01 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 35.5 mtp180 -67.12 -48.4 68.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 2.1600000000000001 110.802 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 24.8 t70 -53.7 -46.82 70.86 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.515 0.198 . . . . 1.0600000000000001 111.028 176.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.666 ' O ' HD23 ' A' ' 25' ' ' LEU . 40.3 t80 -53.44 -60.3 3.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.985 -0.552 . . . . 0.65000000000000002 111.049 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.538 HD21 ' CE1' ' A' ' 100' ' ' TYR . 83.8 mt -74.75 -4.66 38.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 119.31 0.959 . . . . 1.1299999999999999 112.388 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 43.4 mt-30 -71.92 -46.26 58.25 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 122.314 -0.241 . . . . 2.0600000000000001 111.405 162.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -83.37 -26.88 30.09 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.525 0.565 . . . . 1.8400000000000001 112.525 -175.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.666 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -63.13 134.9 56.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.841 -0.429 . . . . 1.05 109.841 166.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.506 ' HB3' ' SD ' ' A' ' -14' ' ' MET . 49.8 m -159.23 55.27 0.4 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.236 0.458 . . . . 1.78 112.236 -174.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.464 ' OD1' ' HG3' ' A' ' 0' ' ' MET . 20.0 t70 71.98 143.06 0.06 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.325 0.584 . . . . 2.3900000000000001 111.238 176.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.02 -49.14 4.07 Favored Glycine 0 N--CA 1.451 -0.32 0 N-CA-C 110.776 -0.93 . . . . 0.93000000000000005 110.776 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 4.7 p30 -78.72 -49.43 13.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.112 -0.544 . . . . 2.25 110.28 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 89.2 mttt -55.32 -26.45 40.73 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.377 0.608 . . . . 1.3100000000000001 110.703 174.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 14.9 m -64.69 -32.87 74.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.212 -0.903 . . . . 0.80000000000000004 111.102 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.8 p -90.62 -23.61 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.23 -0.441 . . . . 0.84999999999999998 110.512 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.59 -49.03 71.39 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.49 -0.323 . . . . 0.97999999999999998 110.895 171.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 20.9 ptmt -65.43 -27.67 68.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.424 -0.353 . . . . 2.4100000000000001 111.407 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -67.26 -37.33 83.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 1.96 110.157 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 51' ' ' ALA . 61.4 t -73.54 -53.97 16.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.252 0.549 . . . . 0.97999999999999998 110.468 177.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HE1' HD12 ' A' ' 33' ' ' LEU . 27.5 m-85 -53.93 -45.11 71.14 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.345 1.239 . . . . 0.82999999999999996 114.345 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -79.08 -1.4 35.64 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 119.988 -0.685 . . . . 2.1800000000000002 111.16 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -99.82 17.08 21.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.394 0.616 . . . . 1.5600000000000001 109.668 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -88.06 -160.61 36.01 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.444 -0.798 . . . . 1.54 111.62 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.78 160.8 95.45 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 123.334 -1.527 . . . . 1.6799999999999999 112.256 -1.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -112.52 127.29 56.02 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.136 0.493 . . . . 1.28 110.252 177.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -65.65 -21.98 66.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.862 -1.063 . . . . 3.5099999999999998 110.996 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.77 141.48 20.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.735 -0.666 . . . . 1.52 110.093 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.4 m -57.72 -28.31 63.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.242 -0.89 . . . . 1.1799999999999999 112.215 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.64 -34.93 69.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.256 -0.429 . . . . 2.2400000000000002 111.695 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.24 -34.22 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.689 0.255 . . . . 2.2599999999999998 111.689 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m -64.57 -41.02 96.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.309 0.576 . . . . 1.1899999999999999 109.821 176.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.9 mt -67.19 -43.14 88.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.392 -0.822 . . . . 0.55000000000000004 110.561 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -58.11 -47.25 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.364 -0.835 . . . . 0.56999999999999995 110.824 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.488 ' HB3' HG13 ' A' ' 36' ' ' VAL . . . -59.38 -37.46 77.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.084 -0.507 . . . . 0.5 110.481 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.518 HD21 HD13 ' A' ' 33' ' ' LEU . 21.3 mt -69.74 -40.32 76.26 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.529 -0.759 . . . . 0.45000000000000001 110.891 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -66.56 -23.5 66.22 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.848 0.356 . . . . 1.22 111.776 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -80.41 -26.59 38.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.097 0.475 . . . . 3.0499999999999998 110.622 176.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.551 ' HB3' HG21 ' A' ' 32' ' ' VAL . 18.4 mmtt -91.95 -58.91 2.25 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.977 -0.556 . . . . 1.48 111.058 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.5 t -131.02 104.15 15.36 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-O 121.294 0.569 . . . . 1.1599999999999999 109.493 -175.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.08 -52.9 7.48 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 123.645 2.897 . . . . 0.57999999999999996 112.129 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -61.31 -41.38 96.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.612 -1.176 . . . . 2.4500000000000002 112.196 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.7 -40.01 73.11 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 119.443 -0.903 . . . . 1.4199999999999999 109.639 -173.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.69 -36.6 93.51 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 114.614 -1.175 . . . . 0.37 111.61 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.82 94.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.719 0.295 . . . . 0.47999999999999998 110.652 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -56.99 -59.66 4.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.926 -0.579 . . . . 2.1699999999999999 110.911 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.97 -32.91 59.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.421 . . . . 1.1200000000000001 111.744 -177.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.603 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -62.52 -55.61 25.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 1.7 110.484 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 69' ' ' MET . 9.0 mtpm? -67.42 -33.09 74.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.548 0.69 . . . . 3.96 110.104 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 17' ' ' GLU . 15.2 tp -66.52 -50.38 63.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.959 -1.019 . . . . 1.5 111.83 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.503 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.9 OUTLIER -74.57 -21.73 59.35 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.185 -0.672 . . . . 2.3399999999999999 109.185 -174.433 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.49 99.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.905 -1.043 . . . . 0.40000000000000002 110.648 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 28.4 mtm -63.45 -44.3 94.9 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.483 -0.562 . . . . 0.71999999999999997 109.483 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.42 -49.21 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 114.996 -1.002 . . . . 0.79000000000000004 110.299 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -62.45 -36.69 83.23 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 115.554 -0.748 . . . . 1.47 111.517 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -63.79 -41.12 98.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.92 0.39 . . . . 1.26 111.211 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 60.2 mttp -67.96 -44.88 75.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.213 -0.449 . . . . 1.54 110.039 177.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.4 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 79.1 mt -68.48 -22.57 27.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.456 0.646 . . . . 0.34000000000000002 110.614 177.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.14 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.791 0.805 . . . . 0.34999999999999998 109.744 177.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.46 -2.04 56.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.421 -1.263 . . . . 0.48999999999999999 110.397 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.9 tp -93.82 134.77 35.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.403 -0.817 . . . . 0.70999999999999996 110.114 -174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.39 155.41 40.18 Favored Glycine 0 C--O 1.225 -0.445 0 CA-C-O 119.669 -0.517 . . . . 0.76000000000000001 112.619 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -43.19 -43.21 10.06 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 124.072 3.182 . . . . 1.5600000000000001 114.49 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -66.22 -54.13 28.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.719 0.295 . . . . 2.52 110.265 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.67 -32.0 63.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.462 -0.495 . . . . 0.35999999999999999 110.59 -174.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.5 ttpt -61.53 -51.94 66.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 2.04 111.341 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.04 -34.62 89.55 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.356 -0.926 . . . . 0.40999999999999998 111.214 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.86 -49.1 64.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.029 -0.585 . . . . 1.6499999999999999 112.252 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.44 63.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.762 -0.654 . . . . 0.40999999999999998 111.753 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.75 -20.5 63.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.899 -0.591 . . . . 1.96 111.142 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 14.4 tppt? -90.22 -42.28 11.11 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.079 0.466 . . . . 2.1200000000000001 111.074 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -71.43 -43.78 66.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.99 0.424 . . . . 0.56999999999999995 110.998 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.471 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 77.9 mt -67.85 -30.37 48.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 1.0900000000000001 111.935 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 10.6 pt-20 -67.15 -28.73 68.37 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.15 -0.62 . . . . 2.8199999999999998 109.981 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.1 mt -67.29 -45.15 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 109.401 -0.592 . . . . 0.51000000000000001 109.401 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.25 -39.16 91.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.79 -0.641 . . . . 0.64000000000000001 110.604 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 19.1 mtm180 -68.41 -28.75 67.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.645 -0.707 . . . . 4.4199999999999999 110.617 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -73.78 -31.67 60.03 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.266 -0.492 . . . . 0.66000000000000003 112.351 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.16 -50.63 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.034 0.445 . . . . 0.55000000000000004 110.274 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.467 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 20.9 pttp -79.28 -7.71 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 2.7000000000000002 110.942 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.407 ' HA ' ' HD2' ' A' ' 100' ' ' TYR . . . -70.43 -33.76 71.7 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.425 -0.583 . . . . 0.63 109.425 168.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.633 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 78.6 mtp180 -85.44 -3.94 59.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.805 -0.634 . . . . 3.1000000000000001 110.0 175.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 20.5 m-85 -88.25 -32.21 18.64 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.988 -0.685 . . . . 0.96999999999999997 109.457 166.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.538 ' CE1' HD21 ' A' ' 22' ' ' LEU . 35.2 m-85 -69.6 -54.66 12.95 Favored 'General case' 0 N--CA 1.46 0.047 0 CA-C-O 121.022 0.439 . . . . 1.48 110.631 176.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.404 ' CG2' ' HB3' ' A' ' 37' ' ' PHE . 33.0 p -61.21 -26.92 68.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.273 0.842 . . . . 0.87 113.273 -172.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 103.47 -10.7 53.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.62 -0.8 . . . . 1.1599999999999999 112.141 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.633 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 91.5 m-20 -85.07 57.95 4.74 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.302 -0.258 . . . . 1.8300000000000001 110.302 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.93 125.61 18.26 Favored Pre-proline 0 N--CA 1.464 0.251 0 N-CA-C 112.797 0.666 . . . . 1.75 112.797 -172.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.33 142.75 30.56 Favored 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.811 2.341 . . . . 0.53000000000000003 111.324 175.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -78.18 169.47 18.21 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.493 -0.558 . . . . 1.48 109.493 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.416 ' NZ ' ' HB2' ' A' ' 107' ' ' LYS . 4.3 ttmp? -61.33 -34.59 75.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 118.26 0.482 . . . . 2.8799999999999999 110.648 -174.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -65.35 -30.21 71.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.798 -0.637 . . . . 2.2400000000000002 110.982 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -63.56 -40.21 96.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.246 0.546 . . . . 1.73 110.235 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.639 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -71.39 -42.42 68.41 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.515 -0.766 . . . . 0.81999999999999995 110.652 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -55.76 -42.73 75.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.094 0.473 . . . . 1.74 110.068 176.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.538 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -67.51 -39.08 85.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.854 -0.612 . . . . 0.46999999999999997 112.337 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.52 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 3.9 p -74.29 -33.31 63.21 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.436 0.532 . . . . 1.3400000000000001 112.436 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.703 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -74.3 -27.41 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 107.83 -1.174 . . . . 0.65000000000000002 107.83 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.598 ' HG3' ' OE1' ' A' ' 154' ' ' GLU . 23.0 ttmm -64.24 -35.42 80.78 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.882 -1.508 . . . . 1.72 110.775 177.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.442 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.5 mt-10 -77.02 -40.05 47.98 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.112 -0.635 . . . . 2.27 111.076 178.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 114' ' ' VAL . 5.5 m -66.79 -24.62 32.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.359 -0.536 . . . . 0.81000000000000005 110.229 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -84.19 -37.83 21.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.387 -0.37 . . . . 1.21 111.117 171.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 116' ' ' GLU . 36.5 ttpt -55.86 -44.12 77.77 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.297 -1.001 . . . . 0.94999999999999996 108.297 176.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.4 mp -69.25 -54.47 14.56 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 113.947 -1.478 . . . . 1.0600000000000001 111.867 174.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -69.37 -31.31 69.63 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 119.684 -0.806 . . . . 1.54 111.803 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -66.33 -28.44 68.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.848 0.356 . . . . 1.98 110.976 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.83 -3.36 58.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.167 0.803 . . . . 0.69999999999999996 113.167 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.0 mtm -77.4 158.18 30.2 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.851 -0.74 . . . . 0.5 110.663 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 34.6 t -66.18 149.73 49.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.796 -0.446 . . . . 1.1799999999999999 109.796 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -53.11 -43.75 67.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.603 0.24 . . . . 2.21 111.266 -176.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -70.02 -34.91 73.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.41999999999999998 110.973 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.5 -45.14 80.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.952 -0.567 . . . . 0.31 112.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -74.73 -24.97 58.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.328 . . . . 1.3200000000000001 110.485 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.86 -45.28 94.48 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.538 0.685 . . . . 0.41999999999999998 110.509 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.15 -28.93 63.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.859 -1.064 . . . . 0.55000000000000004 109.679 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -62.19 -30.05 70.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.324 -0.853 . . . . 0.39000000000000001 109.295 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.09 -7.24 88.58 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.664 -0.698 . . . . 0.27000000000000002 112.936 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -88.98 -40.98 12.64 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-O 121.342 0.591 . . . . 2.4300000000000002 110.155 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.457 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 44.2 mm-40 -85.98 -30.34 22.82 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.091 -0.959 . . . . 1.8300000000000001 110.57 -177.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.96 70.86 78.53 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.057 0.456 . . . . 0.68999999999999995 110.635 173.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.24 -27.28 72.21 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.953 2.435 . . . . 0.63 112.088 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 25.8 t80 -66.34 -39.49 89.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.799 -0.637 . . . . 2.3100000000000001 110.399 -178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.3 -42.11 17.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.105 -0.498 . . . . 1.02 110.793 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.81 -34.31 71.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.475 -0.565 . . . . 0.34999999999999998 109.475 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 28.6 tptp -50.5 -75.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.163 -0.926 . . . . 2.5800000000000001 111.633 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.461 HG21 ' HA ' ' A' ' 13' ' ' LEU . 1.5 m -63.68 -27.64 43.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.794 -0.639 . . . . 0.5 112.616 -172.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.79 -44.94 69.05 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.382 -0.527 . . . . 0.62 110.446 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -83.17 -27.27 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.401 -0.363 . . . . 2.5800000000000001 111.265 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 9.7 t -71.51 -19.59 62.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.927 0.394 . . . . 1.3200000000000001 110.67 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 102.74 -10.35 55.85 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.619 -0.801 . . . . 1.0900000000000001 112.583 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.547 ' HG3' HD21 ' A' ' 13' ' ' LEU . 46.2 tptt -54.55 -48.15 72.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.854 0.359 . . . . 1.98 110.79 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.408 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -75.36 -44.77 43.27 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.24 -0.436 . . . . 0.34000000000000002 110.922 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -56.13 -40.07 73.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.696 -0.684 . . . . 0.51000000000000001 112.611 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 4.8 mptp? -83.41 -16.55 45.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 2.8199999999999998 110.901 -177.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -78.81 -35.13 44.64 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.45 -0.574 . . . . 0.48999999999999999 109.45 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.703 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.58 -27.25 51.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.754 -0.657 . . . . 0.58999999999999997 110.955 176.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 61.4 75.76 0.28 Allowed Glycine 0 C--O 1.237 0.289 0 C-N-CA 120.945 -0.645 . . . . 1.6200000000000001 111.958 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.648 ' HG3' HD22 ' A' ' 155' ' ' ASN . 8.6 pt-20 -159.05 9.46 0.13 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.715 0.635 . . . . 4.1200000000000001 112.715 -175.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.648 HD22 ' HG3' ' A' ' 154' ' ' GLU . 10.2 p30 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.494 -0.765 . . . . 4.0099999999999998 109.548 -175.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 120.785 0.326 . . . . 23.59 110.553 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -94.48 -35.18 6.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.634 -0.794 . . . . 22.469999999999999 112.663 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 26.1 t -80.68 105.31 11.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.049 0.452 . . . . 21.510000000000002 110.22 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 4.0 p -79.41 58.97 2.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.356 0.598 . . . . 20.190000000000001 111.493 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 56.9 m80 -117.21 1.9 12.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.445 0.64 . . . . 21.420000000000002 109.38 173.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -159.16 129.06 5.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.164 -0.925 . . . . 18.199999999999999 109.727 -177.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -105.11 103.36 12.89 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.667 -0.494 . . . . 16.059999999999999 109.667 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -73.12 137.94 45.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.229 -0.441 . . . . 13.27 110.503 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -80.88 95.13 6.63 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.428 -0.582 . . . . 12.33 109.428 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -65.36 -18.45 65.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.622 -0.717 . . . . 11.33 110.712 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 2.5 m -66.73 -19.11 65.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.791 -0.64 . . . . 7.9500000000000002 110.927 177.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 39.8 m -89.99 -5.74 56.35 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.258 -0.428 . . . . 7.3600000000000003 110.892 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -66.47 -62.05 4.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 4.5700000000000003 111.565 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -90.73 102.53 15.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.361 -0.607 . . . . 4.5199999999999996 109.361 175.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 28.1 ttm -102.4 109.81 21.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.37 -0.377 . . . . 2.0 110.718 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.457 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 55.2 t80 -44.41 129.95 6.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.285 -0.87 . . . . 1.47 112.179 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 4' ' ' GLU . 1.6 tmtm? -123.12 114.91 20.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.647 -0.706 . . . . 3.1499999999999999 109.21 177.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -68.35 -24.07 64.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.314 0.578 . . . . 2.3500000000000001 110.204 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 2' ' ' LYS . 44.8 mt-10 -86.1 -2.73 58.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.59 -0.732 . . . . 4.1600000000000001 110.394 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -94.08 -10.76 32.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.549 0.69 . . . . 2.5699999999999998 109.529 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.0 mt -80.74 131.6 60.16 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.345 -0.843 . . . . 0.68999999999999995 109.021 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -37.81 115.36 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.745 2.964 . . . . 0.59999999999999998 112.679 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.17 -17.78 64.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.56999999999999995 111.551 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -74.67 -26.58 59.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.92 0.867 . . . . 1.3700000000000001 109.299 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 65.4 t80 -85.13 -31.42 23.31 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.228 -1.351 . . . . 0.80000000000000004 110.656 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -67.88 -18.55 64.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.301 0.572 . . . . 1.73 110.028 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.71 -21.64 64.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.185 -0.916 . . . . 1.02 110.748 175.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.543 HD21 ' HD2' ' A' ' 147' ' ' LYS . 90.7 mt -87.4 -6.99 58.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.069 -0.514 . . . . 0.93000000000000005 110.916 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 63.6 mtt -86.75 126.98 61.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.341 -0.391 . . . . 1.1499999999999999 110.63 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -75.35 155.39 41.31 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.36 2.04 . . . . 0.90000000000000002 111.572 175.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.17 -49.37 7.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.577 2.851 . . . . 0.95999999999999996 113.492 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -51.36 -51.42 54.7 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.831 0.348 . . . . 1.8300000000000001 111.605 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.34 -28.18 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.809 0.337 . . . . 0.81999999999999995 111.405 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -76.55 -39.01 54.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.359 -0.382 . . . . 2.1600000000000001 110.465 178.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -46.71 -55.38 7.87 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.934 0.771 . . . . 1.0600000000000001 110.976 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' HB2' HD22 ' A' ' 66' ' ' LEU . 40.8 t80 -56.43 -63.39 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.673 -0.694 . . . . 0.65000000000000002 112.366 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -75.1 -5.36 43.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 119.223 0.92 . . . . 1.1299999999999999 111.72 -174.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -74.41 -37.49 63.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.008 0.432 . . . . 2.0600000000000001 110.377 162.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.37 -48.09 74.14 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.786 -0.643 . . . . 1.8400000000000001 111.717 -177.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.405 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.6 mm? -57.59 137.09 56.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.195 0.522 . . . . 1.05 110.578 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -131.58 -64.22 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.683 -0.689 . . . . 1.78 111.93 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 2.7 p-10 -135.76 -90.49 0.3 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.599 0.592 . . . . 2.3900000000000001 112.599 -173.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.402 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -62.54 -19.73 60.58 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 114.153 0.421 . . . . 0.93000000000000005 114.153 -171.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.574 ' O ' HG12 ' A' ' 32' ' ' VAL . 36.6 m-20 -76.82 -34.82 57.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.983 0.391 . . . . 2.25 110.93 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 1' ' ' PHE . 95.7 mttt -65.67 -27.38 68.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.524 0.678 . . . . 1.3100000000000001 110.487 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 66.0 m -60.71 -38.18 84.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.917 -1.038 . . . . 0.80000000000000004 111.246 176.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.623 HG21 ' HB3' ' A' ' 55' ' ' LYS . 6.2 p -89.91 -21.87 6.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.982 -0.554 . . . . 0.84999999999999998 111.581 -173.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.48 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 3.1 mm? -50.41 -50.91 50.46 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.804 0.298 . . . . 0.97999999999999998 111.804 172.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 9.2 ptpp? -65.72 -25.02 67.11 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.809 0.338 . . . . 2.4100000000000001 111.395 -176.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.55 -31.58 68.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.224 0.535 . . . . 1.96 109.891 176.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 89.7 t -74.71 -51.19 23.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.489 -0.778 . . . . 0.97999999999999998 110.19 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -53.69 -42.79 68.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.233 0.827 . . . . 0.82999999999999996 113.233 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.41 21.55 2.85 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.876 -0.73 . . . . 2.1800000000000002 111.023 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -122.11 12.38 10.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.827 -0.624 . . . . 1.5600000000000001 110.081 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.03 -156.82 10.41 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.71 -0.677 . . . . 1.54 112.19 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.69 165.12 84.61 Favored 'Cis proline' 0 C--N 1.343 0.281 0 C-N-CA 123.809 -1.33 . . . . 1.6799999999999999 112.981 0.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.462 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 54.7 m-85 -123.12 124.81 43.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.604 -0.725 . . . . 1.28 110.379 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -79.68 -20.53 46.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.211 -0.904 . . . . 3.5099999999999998 110.575 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.516 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.4 p30 -144.75 174.27 11.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.142 -0.481 . . . . 1.52 110.889 -171.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.1 m -72.06 -39.5 69.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.482 -0.326 . . . . 1.1799999999999999 111.091 -178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -59.05 -42.29 89.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.101 -0.499 . . . . 2.2400000000000002 111.751 -172.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.7 mt-10 -54.96 -39.57 69.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.802 0.334 . . . . 2.2599999999999998 111.485 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.7 m -72.71 -42.09 64.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.245 -0.434 . . . . 1.1899999999999999 110.442 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 60.7 mt -65.46 -38.33 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.55000000000000004 110.281 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.58 -52.51 64.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.375 -0.829 . . . . 0.56999999999999995 111.186 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.74 77.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.752 -0.658 . . . . 0.5 110.328 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.489 HD22 HD22 ' A' ' 59' ' ' LEU . 37.1 mt -70.3 -40.66 74.11 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.12 -0.946 . . . . 0.45000000000000001 111.41 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -66.52 -23.49 66.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.064 0.459 . . . . 1.22 111.26 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.33 -50.98 10.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 3.0499999999999998 109.92 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 51.7 mmtt -67.35 -62.21 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.784 -0.643 . . . . 1.48 111.909 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -132.33 90.8 33.14 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 116.043 -0.526 . . . . 1.1599999999999999 109.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -41.55 -57.51 1.43 Allowed 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.829 3.019 . . . . 0.57999999999999996 113.685 -171.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 30.5 tt0 -62.69 -27.03 68.97 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.234 -0.894 . . . . 2.4500000000000002 111.982 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 2.2 tt -70.79 -46.25 63.2 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.786 -1.19 . . . . 1.4199999999999999 107.786 -178.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.98 -32.07 83.02 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 114.407 -1.269 . . . . 0.37 111.318 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.43 91.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.666 0.269 . . . . 0.47999999999999998 110.457 174.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 61.7 mttp -54.54 -53.4 54.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.995 -0.548 . . . . 2.1699999999999999 110.125 175.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.503 HG22 ' CE1' ' A' ' 21' ' ' PHE . 1.8 t -65.25 -41.61 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.708 -0.678 . . . . 1.1200000000000001 111.02 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.39 -55.19 37.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.785 -0.643 . . . . 1.7 110.698 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 69' ' ' MET . 8.6 mtpm? -63.48 -41.14 98.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.343 0.592 . . . . 3.96 110.304 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 70' ' ' VAL . 16.4 tp -62.97 -50.59 70.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.331 -0.85 . . . . 1.5 112.298 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.6 ' O ' HG22 ' A' ' 70' ' ' VAL . 5.3 p-80 -77.23 -17.23 58.62 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.881 -0.785 . . . . 2.3399999999999999 108.881 -172.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.0 81.12 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.625 -0.716 . . . . 0.40000000000000002 109.879 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 21.5 mtm -67.86 -46.85 70.56 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.281 -0.637 . . . . 0.71999999999999997 109.281 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 66' ' ' LEU . 2.3 m -62.13 -35.27 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.625 -0.716 . . . . 0.79000000000000004 109.832 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -65.42 -41.99 92.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.004 -0.544 . . . . 1.47 110.663 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 m -59.71 -29.72 68.3 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.197 0.523 . . . . 1.26 110.459 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 87.7 mttt -82.11 -47.01 13.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.557 -0.747 . . . . 1.54 110.837 177.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.9 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.34000000000000002 111.418 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.03 -31.12 71.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.475 0.655 . . . . 0.34999999999999998 110.274 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.47 58.69 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.836 -1.074 . . . . 0.48999999999999999 110.669 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.579 ' CD2' ' HA ' ' A' ' 132' ' ' PHE . 97.4 mt -43.59 140.39 1.8 Allowed 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 112.74 0.644 . . . . 0.70999999999999996 112.74 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 159.6 39.23 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.592 -1.003 . . . . 0.76000000000000001 110.592 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -43.5 -35.82 6.32 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.561 2.841 . . . . 1.5600000000000001 113.522 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.0 -48.35 37.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.523 -0.308 . . . . 2.52 111.15 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.439 ' HB1' HD22 ' A' ' 77' ' ' LEU . . . -72.41 -34.87 68.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.333 0.587 . . . . 0.35999999999999999 110.146 -174.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -58.38 -44.66 88.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.878 -1.055 . . . . 2.04 110.741 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.66 -43.97 97.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.167 -0.539 . . . . 0.40999999999999998 112.54 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -66.87 -44.09 81.83 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.529 0.204 . . . . 1.6499999999999999 110.951 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.69 -46.64 81.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.131 0.491 . . . . 0.40999999999999998 111.28 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 45.5 mt-10 -66.32 -42.43 88.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.66 -0.7 . . . . 1.96 110.529 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.09 -46.94 69.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.396 -0.366 . . . . 2.1200000000000001 111.134 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -60.39 -39.88 88.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.762 0.315 . . . . 0.56999999999999995 110.757 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.1 mt -65.5 -39.69 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 116.392 -0.367 . . . . 1.0900000000000001 110.818 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 54.4 mt-10 -56.62 -48.21 77.97 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.069 0.461 . . . . 2.8199999999999998 110.361 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 113' ' ' SER . 74.5 mt -64.59 -44.23 96.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.471 -0.786 . . . . 0.51000000000000001 110.892 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.6 66.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.05 0.452 . . . . 0.64000000000000001 110.941 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -62.89 -38.72 92.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.987 -0.551 . . . . 4.4199999999999999 110.78 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -71.74 -39.31 60.2 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.06 -0.591 . . . . 0.66000000000000003 113.065 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.41 -54.1 38.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.854 0.359 . . . . 0.55000000000000004 110.779 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.474 ' NZ ' ' HB2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -87.17 29.94 0.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 2.7000000000000002 110.07 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -112.83 -34.85 5.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.994 -1.003 . . . . 0.63 108.755 164.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -80.9 -13.38 58.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 3.1000000000000001 109.798 177.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 20.1 m-85 -77.38 -34.05 55.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.463 -0.569 . . . . 0.96999999999999997 109.463 167.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.48 ' CZ ' ' HG ' ' A' ' 33' ' ' LEU . 1.2 m-85 -77.83 -35.92 50.65 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.956 0.724 . . . . 1.48 112.956 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -65.04 -9.63 23.54 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.586 0.587 . . . . 0.87 112.586 -174.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.89 14.68 22.42 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.754 -0.736 . . . . 1.1599999999999999 111.531 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -117.88 -177.73 3.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.932 -0.396 . . . . 1.8300000000000001 109.932 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.451 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.4 mt-10 -142.52 105.19 5.45 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.318 -0.401 . . . . 1.75 110.729 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.1 Cg_endo -58.1 143.85 95.94 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.835 1.69 . . . . 0.53000000000000003 110.133 170.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.6 p -76.04 170.21 16.71 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.851 -0.426 . . . . 1.48 109.851 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.4 tptm -64.16 -30.37 71.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.136 -0.69 . . . . 2.8799999999999999 109.136 178.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -69.86 -30.11 67.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.373 -0.831 . . . . 2.2400000000000002 110.81 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -60.57 -46.28 90.81 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.801 -0.444 . . . . 1.73 109.801 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.5 mp -65.77 -44.94 84.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.529 -0.76 . . . . 0.81999999999999995 110.918 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 57.6 mtpt -59.41 -39.97 85.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.173 0.511 . . . . 1.74 110.445 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -69.4 -42.89 74.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.727 -0.669 . . . . 0.46999999999999997 111.413 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.421 ' HB2' HG22 ' A' ' 91' ' ' ILE . 51.2 p -61.79 -38.16 87.02 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.072 -0.251 . . . . 1.3400000000000001 111.558 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 117' ' ' VAL . 7.8 m -80.76 -25.83 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.395 0.617 . . . . 0.65000000000000002 109.447 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 41.1 ttmt -55.95 -44.56 78.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.701 -0.681 . . . . 1.72 110.994 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.511 ' O ' HD13 ' A' ' 120' ' ' LEU . 24.0 mt-10 -72.71 -34.21 66.98 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.271 -0.572 . . . . 2.27 111.006 -176.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.4 m -66.16 -34.03 67.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.144 -0.622 . . . . 0.81000000000000005 110.505 178.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 122' ' ' LYS . 4.1 mm? -73.19 -33.78 65.59 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.923 -0.486 . . . . 1.21 110.313 172.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 116' ' ' GLU . 35.4 ttpt -59.01 -45.64 90.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.996 -0.742 . . . . 0.94999999999999996 108.996 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -72.27 -49.9 31.29 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.663 -1.153 . . . . 1.0600000000000001 111.53 176.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.422 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 42.4 t80 -69.79 -37.47 76.33 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 119.849 -0.741 . . . . 1.54 111.747 -168.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.498 ' HE3' HD12 ' A' ' 118' ' ' LEU . 93.0 mttt -64.46 -29.88 70.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.931 0.396 . . . . 1.98 110.896 178.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.17 -6.68 59.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.69999999999999996 112.397 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.407 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 42.2 mtm -76.72 157.08 31.99 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.119 -0.633 . . . . 0.5 110.313 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 70.5 m -70.06 153.39 43.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 121.06 -0.256 . . . . 1.1799999999999999 110.705 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -54.97 -46.07 75.04 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.168 0.433 . . . . 2.21 112.168 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.7 75.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.775 0.322 . . . . 0.41999999999999998 111.076 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -68.14 -38.11 87.72 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.016 -0.538 . . . . 0.31 112.143 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.422 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 99.8 mttt -64.73 -46.39 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.323 0.582 . . . . 1.3200000000000001 110.154 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.05 -34.41 77.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.134 -0.939 . . . . 0.41999999999999998 111.443 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -74.18 -31.66 62.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.683 -0.488 . . . . 0.55000000000000004 109.683 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.579 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . 89.7 t80 -64.07 -34.45 78.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.777 -0.647 . . . . 0.39000000000000001 110.674 175.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.21 -4.91 57.79 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.133 -0.556 . . . . 0.27000000000000002 113.475 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -91.59 -23.14 19.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.567 0.699 . . . . 2.4300000000000002 110.088 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -108.81 -35.82 6.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.052 -0.976 . . . . 1.8300000000000001 110.889 -173.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -128.77 71.61 81.24 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.256 -0.646 . . . . 0.68999999999999995 109.256 171.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.88 -33.88 62.53 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.016 2.478 . . . . 0.63 112.75 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.621 ' O ' HG13 ' A' ' 142' ' ' VAL . 28.6 m-85 -65.98 -30.55 71.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.448 -0.342 . . . . 2.3100000000000001 111.492 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.4 ' HG ' ' CE1' ' A' ' 143' ' ' PHE . 5.9 mp -77.48 -48.23 17.63 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.399 -0.52 . . . . 1.02 110.028 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.16 -31.55 65.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.545 0.688 . . . . 0.34999999999999998 109.854 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 56.2 tttp -58.41 -75.09 0.05 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.804 -1.089 . . . . 2.5800000000000001 111.43 171.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.5 m -64.5 -26.68 40.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 112.895 0.702 . . . . 0.5 112.895 -172.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.4 ' CE1' ' HG ' ' A' ' 139' ' ' LEU . 3.8 m-85 -71.63 -47.89 51.52 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.682 -0.407 . . . . 0.62 110.478 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.24 -23.91 47.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 2.5800000000000001 111.188 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.7 t -70.71 -19.29 62.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.254 0.55 . . . . 1.3200000000000001 109.775 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.471 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 96.86 -9.62 66.01 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.973 -0.632 . . . . 1.0900000000000001 112.582 177.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.543 ' HD2' HD21 ' A' ' 13' ' ' LEU . 8.8 tmtm? -57.14 -50.7 71.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 1.98 110.408 -176.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.5 83.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.34000000000000002 111.092 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.97 80.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.126 -0.488 . . . . 0.51000000000000001 111.812 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 14.4 mmmm -75.36 -35.42 61.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.88 0.371 . . . . 2.8199999999999998 110.352 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.446 ' HD1' HG21 ' A' ' 114' ' ' VAL . 22.2 t80 -61.77 -40.57 95.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.48999999999999999 109.705 173.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.416 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -64.88 -42.37 94.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.602 -0.727 . . . . 0.58999999999999997 111.133 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 64.84 50.01 60.49 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.731 -0.747 . . . . 1.6200000000000001 111.587 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.45 17.73 8.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.992 0.425 . . . . 4.1200000000000001 110.983 -176.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-N 116.047 -0.524 . . . . 4.0099999999999998 110.215 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 120.855 0.36 . . . . 23.59 110.44 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 172.41 161.75 23.41 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 111.391 -0.684 . . . . 22.469999999999999 111.391 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 21.9 m -81.08 59.03 3.69 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 21.510000000000002 111.082 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 9.4 t -102.84 60.88 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.334 0.588 . . . . 20.190000000000001 109.626 178.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -129.45 102.5 6.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.701 . . . . 21.420000000000002 109.454 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.19 124.91 19.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 18.199999999999999 111.267 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -147.39 55.3 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.613 0.72 . . . . 16.059999999999999 110.045 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -62.1 111.66 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.158 -0.928 . . . . 13.27 110.199 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 30.7 m-70 -58.94 111.45 1.31 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.837 -0.619 . . . . 12.33 111.386 -177.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -136.71 30.06 2.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.512 -0.767 . . . . 11.33 109.151 177.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -4' ' ' SER . . . . . 0.457 ' HB2' ' SD ' ' A' ' 0' ' ' MET . 6.2 p -133.76 79.41 1.82 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.154 -0.93 . . . . 7.9500000000000002 111.263 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 40.0 m -140.99 41.47 1.81 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.288 0.566 . . . . 7.3600000000000003 110.077 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -131.76 -50.0 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.65 -0.785 . . . . 4.5700000000000003 112.275 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -132.61 50.42 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.614 0.245 . . . . 4.5199999999999996 111.043 -177.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.457 ' SD ' ' HB2' ' A' ' -4' ' ' SER . 89.1 mmm -101.39 128.8 47.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.875 0.369 . . . . 2.0 110.06 177.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -75.91 138.85 41.3 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.525 0.678 . . . . 1.47 110.906 -178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -107.88 138.11 44.71 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.71 -0.677 . . . . 3.1499999999999999 109.584 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -70.72 -17.26 62.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.433 0.635 . . . . 2.3500000000000001 109.619 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -92.74 2.35 56.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.31 -0.859 . . . . 4.1600000000000001 110.127 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -106.38 -16.15 14.63 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.045 -0.525 . . . . 2.5699999999999998 110.134 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.6 mt -76.6 133.9 70.06 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 108.319 -0.993 . . . . 0.68999999999999995 108.319 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -43.06 116.2 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.298 2.665 . . . . 0.59999999999999998 112.875 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.74 -22.56 67.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.983 -0.553 . . . . 0.56999999999999995 111.491 -175.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.24 -34.45 78.04 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.129 0.966 . . . . 1.3700000000000001 108.925 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.427 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 64.5 t80 -85.37 -24.57 27.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.673 -1.603 . . . . 0.80000000000000004 110.49 -176.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -71.78 -20.46 61.86 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.401 0.62 . . . . 1.73 109.467 177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.61 -19.08 62.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.932 -1.031 . . . . 1.02 110.371 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' A' ' 147' ' ' LYS . 61.8 mt -96.39 12.98 29.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.593 -0.731 . . . . 0.93000000000000005 110.304 178.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 59.8 mtt -100.42 128.75 29.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.217 -0.447 . . . . 1.1499999999999999 110.604 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 21.0 Cg_endo -62.68 137.35 63.24 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.379 2.053 . . . . 0.90000000000000002 110.746 175.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.2 Cg_exo -50.49 -29.58 24.93 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.779 2.986 . . . . 0.95999999999999996 113.656 -175.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.517 ' O ' HD11 ' A' ' 66' ' ' LEU . 20.2 mp0 -64.54 -50.19 68.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.072 0.463 . . . . 1.8300000000000001 110.236 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.18 -29.59 69.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.554 . . . . 0.81999999999999995 110.796 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -68.55 -45.56 71.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.524 . . . . 2.1600000000000001 110.389 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.43 -41.13 65.74 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.45 0.469 . . . . 1.0600000000000001 111.436 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.555 ' O ' HD23 ' A' ' 25' ' ' LEU . 34.2 t80 -60.59 -68.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.849 -0.614 . . . . 0.65000000000000002 111.222 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.559 HD21 ' CE1' ' A' ' 100' ' ' TYR . 69.4 mt -70.01 -6.97 37.12 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 119.2 0.909 . . . . 1.1299999999999999 112.069 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.81 -53.19 50.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.518 0.199 . . . . 2.0600000000000001 110.801 163.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -81.0 -31.65 34.59 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.483 0.549 . . . . 1.8400000000000001 112.483 -173.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -56.41 131.12 47.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.711 0.767 . . . . 1.05 111.023 173.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.1 m -124.37 178.61 5.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.593 -1.185 . . . . 1.78 109.374 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.77 -47.29 64.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.798 0.333 . . . . 2.3900000000000001 111.644 -175.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.59 -48.75 79.3 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.959 -0.639 . . . . 0.93000000000000005 112.538 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.614 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.1 m-20 -65.89 -43.96 86.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.708 0.29 . . . . 2.25 110.999 -178.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.07 -17.58 57.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.438 -0.346 . . . . 1.3100000000000001 111.534 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.3 m -64.77 -43.64 92.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.454 0.645 . . . . 0.80000000000000004 109.888 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.614 HG12 ' O ' ' A' ' 29' ' ' ASP . 2.8 p -79.21 -29.69 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 CA-C-N 115.262 -0.881 . . . . 0.84999999999999998 110.082 -176.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.507 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.88 -42.41 72.04 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 121.044 0.45 . . . . 0.97999999999999998 110.167 169.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HA ' HG22 ' A' ' 101' ' ' THR . 63.3 tttp -62.99 -29.64 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 2.4100000000000001 111.019 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -77.99 -24.98 47.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.96 110.81 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.0 t -80.9 -57.2 5.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.717 0.77 . . . . 0.97999999999999998 110.009 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.412 ' HE1' HD12 ' A' ' 33' ' ' LEU . 17.8 m-85 -54.52 -42.55 70.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.652 -1.158 . . . . 0.82999999999999996 114.116 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.638 ' HE3' ' OG1' ' A' ' 101' ' ' THR . 5.1 mmpt? -86.1 8.27 21.48 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.966 -0.694 . . . . 2.1800000000000002 111.346 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -102.8 -77.98 0.55 Allowed 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.512 -0.767 . . . . 1.5600000000000001 108.975 169.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 44.56 -151.79 0.65 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.99 -0.624 . . . . 1.54 112.947 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -91.0 145.27 15.05 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 118.716 1.258 . . . . 1.6799999999999999 111.421 -8.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.439 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 22.7 m-85 -112.18 120.42 41.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.472 0.653 . . . . 1.28 111.35 -173.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -81.13 -19.2 44.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.822 -1.081 . . . . 3.5099999999999998 110.649 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.416 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -146.09 160.03 42.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.955 -0.566 . . . . 1.52 109.548 -174.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.457 ' O ' HG13 ' A' ' 49' ' ' ILE . 10.0 m -66.29 -30.57 71.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.231 -0.441 . . . . 1.1799999999999999 111.947 -174.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 41.0 tt0 -59.58 -39.45 84.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.968 -0.105 . . . . 2.2400000000000002 111.234 -177.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 43.7 mt-10 -60.55 -46.38 90.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.615 -0.266 . . . . 2.2599999999999998 111.311 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -65.76 -34.32 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 1.1899999999999999 110.919 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 45' ' ' THR . 88.6 mt -67.2 -41.79 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.55000000000000004 110.21 177.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.535 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -57.4 -51.76 68.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.56999999999999995 111.249 177.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.29 -42.56 77.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.5 110.511 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 18.7 mt -66.64 -39.09 88.11 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.45000000000000001 111.169 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -63.92 -31.02 72.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.22 111.03 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -73.99 -46.22 45.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.257 0.551 . . . . 3.0499999999999998 110.293 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 32' ' ' VAL . 61.0 mmtt -66.81 -59.0 3.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.526 -0.761 . . . . 1.48 111.737 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 m -140.65 101.98 6.54 Favored Pre-proline 0 C--N 1.311 -1.103 0 CA-C-O 121.274 0.559 . . . . 1.1599999999999999 109.564 -176.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -43.52 -47.97 8.91 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.32 3.347 . . . . 0.57999999999999996 112.798 -176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 11.7 pt-20 -62.86 -39.87 95.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.562 -1.199 . . . . 2.4500000000000002 112.558 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -72.22 -40.86 67.48 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.758 0.79 . . . . 1.4199999999999999 109.418 -172.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.08 -34.18 89.26 Favored Glycine 0 N--CA 1.441 -1.005 0 CA-C-N 114.427 -1.261 . . . . 0.37 111.62 176.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.53 -38.14 80.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.748 0.309 . . . . 0.47999999999999998 110.365 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.0 mmmt -58.01 -60.16 4.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.98 -0.555 . . . . 2.1699999999999999 110.697 177.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.14 -34.18 65.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 1.1200000000000001 111.309 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 49' ' ' ILE . 40.5 tt0 -57.88 -66.06 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.425 . . . . 1.7 111.237 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 69' ' ' MET . 55.5 mtmt -67.04 -32.35 73.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.381 0.61 . . . . 3.96 110.641 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.517 HD11 ' O ' ' A' ' 17' ' ' GLU . 1.4 tp -65.81 -47.03 76.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.21 -0.904 . . . . 1.5 111.196 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -76.05 -22.57 55.55 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.584 -0.895 . . . . 2.3399999999999999 108.584 -176.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.23 68.67 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.022 -0.99 . . . . 0.40000000000000002 110.773 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 31.3 mtm -65.76 -46.99 76.71 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.635 -0.876 . . . . 0.71999999999999997 108.635 172.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.552 ' HA ' ' HD3' ' A' ' 73' ' ' LYS . 48.3 t -58.06 -44.16 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.446 -1.252 . . . . 0.79000000000000004 110.098 176.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -63.94 -39.81 95.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.321 -0.854 . . . . 1.47 110.339 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.8 t -58.97 -49.3 78.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.073 -0.512 . . . . 1.26 111.459 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -72.36 -36.27 68.72 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.056 -0.258 . . . . 1.54 111.017 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.417 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.9 mt -67.08 -30.23 48.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.085 0.469 . . . . 0.34000000000000002 110.676 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.43 -30.09 71.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.431 0.634 . . . . 0.34999999999999998 110.493 173.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.35 -4.5 59.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.277 -0.874 . . . . 0.48999999999999999 110.697 -178.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 135' ' ' GLN . 7.4 tp -91.12 139.73 30.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.372 -0.831 . . . . 0.70999999999999996 109.847 -176.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 155.61 53.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 0.76000000000000001 111.967 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -44.5 -38.87 12.36 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.824 3.016 . . . . 1.5600000000000001 113.835 -175.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -65.01 -57.02 9.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.116 0.484 . . . . 2.52 110.357 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -75.61 -32.37 60.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.35999999999999999 110.961 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.3 ttpt -59.72 -39.5 84.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.669 -0.696 . . . . 2.04 110.726 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.28 97.71 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.259 -0.972 . . . . 0.40999999999999998 111.527 177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.8 t80 -65.4 -41.94 93.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.566 0.222 . . . . 1.6499999999999999 111.134 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.38 -43.43 79.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.40999999999999998 111.038 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -84.72 -21.22 30.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.309 -0.405 . . . . 1.96 110.756 -177.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -73.61 -45.12 54.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.949 0.404 . . . . 2.1200000000000001 110.06 176.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.7 p -62.26 -34.21 76.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.231 -0.44 . . . . 0.56999999999999995 110.616 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.2 mt -68.77 -45.88 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.352 -0.386 . . . . 1.0900000000000001 111.782 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.15 -29.31 70.69 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.59 -0.444 . . . . 2.8199999999999998 110.922 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.9 mt -75.68 -44.9 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.15 0.5 . . . . 0.51000000000000001 109.937 175.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.423 ' O ' ' HD3' ' A' ' 96' ' ' LYS . . . -64.54 -31.2 72.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.829 -0.623 . . . . 0.64000000000000001 110.864 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -56.59 -51.89 66.93 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.092 -0.503 . . . . 4.4199999999999999 110.582 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.73 94.7 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.996 -0.621 . . . . 0.66000000000000003 112.961 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.8 mm -63.83 -52.85 51.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.342 . . . . 0.55000000000000004 111.095 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 100' ' ' TYR . 9.9 mptt -83.86 -13.29 53.99 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.311 -0.556 . . . . 2.7000000000000002 110.806 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.82 -24.94 67.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 118.327 0.512 . . . . 0.63 110.101 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.3 mtp180 -87.77 -24.84 23.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.074 -0.512 . . . . 3.1000000000000001 110.072 175.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -75.2 -37.97 60.95 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.96999999999999997 109.796 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.559 ' CE1' HD21 ' A' ' 22' ' ' LEU . 3.3 m-85 -52.85 -27.58 19.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.544 -0.753 . . . . 1.48 112.838 -176.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.638 ' OG1' ' HE3' ' A' ' 38' ' ' LYS . 17.5 p -131.05 32.96 4.23 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 118.427 -1.309 . . . . 0.87 113.273 -176.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 79.62 1.41 86.65 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.699 -0.763 . . . . 1.1599999999999999 114.003 170.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 90.4 m-20 -88.71 52.81 2.52 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.969 -0.752 . . . . 1.8300000000000001 108.969 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.505 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 34.3 mt-10 -53.1 115.41 7.45 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 114.469 -1.241 . . . . 1.75 113.395 -169.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 19.4 Cg_endo -64.61 154.07 74.12 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.859 2.373 . . . . 0.53000000000000003 111.178 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.454 HG23 ' H ' ' A' ' 108' ' ' ASP . 13.5 t -87.22 173.08 9.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.263 -0.643 . . . . 1.48 109.263 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -64.69 -22.91 67.09 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.224 -0.59 . . . . 2.8799999999999999 110.787 -175.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.454 ' H ' HG23 ' A' ' 106' ' ' THR . 18.2 m-20 -62.79 -44.16 96.91 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.175 -0.306 . . . . 2.2400000000000002 110.175 175.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -57.26 -44.23 83.71 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.304 0.573 . . . . 1.73 110.214 177.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.9 mp -68.04 -48.53 65.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.126 -0.943 . . . . 0.81999999999999995 111.213 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -63.94 -32.39 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.018 0.437 . . . . 1.74 110.211 -177.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.07 65.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.46999999999999997 111.423 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.0 p -62.49 -34.86 77.7 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.831 0.308 . . . . 1.3400000000000001 111.831 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 152' ' ' ALA . 2.7 m -84.49 -24.15 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.674 0.749 . . . . 0.65000000000000002 109.286 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -62.75 -42.77 99.83 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.126 -0.943 . . . . 1.72 111.28 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.578 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.8 mt-10 -69.1 -36.87 78.02 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 119.985 -0.686 . . . . 2.27 110.975 -178.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -66.12 -27.53 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.103 -0.639 . . . . 0.81000000000000005 109.844 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.489 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.0 mt -74.59 -37.81 62.79 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.693 -0.484 . . . . 1.21 109.693 172.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -57.83 -42.71 84.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.232 0.539 . . . . 0.94999999999999996 109.678 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.2 mm? -69.25 -49.79 53.03 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.343 -0.844 . . . . 1.0600000000000001 111.347 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 49.1 t80 -73.47 -29.36 62.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.907 -1.117 . . . . 1.54 111.665 -169.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -70.4 -38.92 74.72 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.588 -0.523 . . . . 1.98 109.588 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -92.15 68.85 5.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.514 0.673 . . . . 0.69999999999999996 110.985 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.56 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 41.8 mtm -147.77 152.4 37.66 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.978 -1.01 . . . . 0.5 109.325 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.4 m -66.55 140.36 57.97 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.293 -0.262 . . . . 1.1799999999999999 110.293 175.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -51.53 -42.14 61.56 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.401 0.519 . . . . 2.21 112.401 -168.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.46 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.958 0.355 . . . . 0.41999999999999998 111.958 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -82.5 -29.76 35.25 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.89 -0.671 . . . . 0.31 111.537 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -71.06 -47.78 56.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.024 0.44 . . . . 1.3200000000000001 110.29 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.8 65.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.83 -0.623 . . . . 0.41999999999999998 111.193 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.16 -31.12 60.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.267 -0.424 . . . . 0.55000000000000004 110.258 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -61.38 -27.69 68.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.761 -0.654 . . . . 0.39000000000000001 110.38 176.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.63 -13.31 78.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.066 -0.588 . . . . 0.27000000000000002 113.303 -178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -87.74 -39.95 14.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.736 0.779 . . . . 2.4300000000000002 109.536 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.423 ' HB2' HD13 ' A' ' 77' ' ' LEU . 2.0 mp0 -87.37 -36.11 17.97 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.662 -1.154 . . . . 1.8300000000000001 111.539 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -128.78 71.67 81.3 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 120.797 0.332 . . . . 0.68999999999999995 110.693 176.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -61.46 -40.51 47.49 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.906 2.404 . . . . 0.63 112.32 -176.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 60.5 t80 -62.46 -41.67 98.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 2.3100000000000001 111.276 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 85.4 mt -76.02 -42.13 48.89 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.639 -0.424 . . . . 1.02 110.383 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.51 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.23 0.538 . . . . 0.34999999999999998 110.05 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.6 tttt -49.63 -71.67 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.158 -0.928 . . . . 2.5800000000000001 111.481 171.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.5 m -64.3 -25.85 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.406 -0.815 . . . . 0.5 112.559 -171.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -71.27 -49.71 40.18 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 119.716 -0.794 . . . . 0.62 110.132 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -73.99 -34.3 64.14 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.298 -0.41 . . . . 2.5800000000000001 111.2 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.5 t -66.03 -19.54 65.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.223 -0.444 . . . . 1.3200000000000001 110.502 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.48 4.79 62.15 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.59 -0.814 . . . . 1.0900000000000001 112.232 178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' A' ' 13' ' ' LEU . 17.0 tptm -64.9 -51.07 63.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.813 0.339 . . . . 1.98 110.303 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.39 -40.39 81.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.01 0.433 . . . . 0.34000000000000002 110.223 177.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.489 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.91 -43.99 81.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.673 -0.694 . . . . 0.51000000000000001 111.554 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.94 -25.47 61.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.259 -0.428 . . . . 2.8199999999999998 111.504 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -74.36 -35.54 63.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.049 0.452 . . . . 0.48999999999999999 110.073 176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.646 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -81.39 -37.09 28.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 0.58999999999999997 112.017 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.41 9.24 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 110.297 -1.121 . . . . 1.6200000000000001 110.297 -169.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 68.17 170.58 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.718 0.807 . . . . 4.1200000000000001 111.805 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.546 -0.74 . . . . 4.0099999999999998 109.62 177.139 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 121.002 0.429 . . . . 23.59 110.211 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -108.14 81.59 0.29 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.734 -0.746 . . . . 22.469999999999999 112.063 -179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 48.8 m -76.06 75.67 2.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.094 0.474 . . . . 21.510000000000002 110.37 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 33.0 t -75.06 106.15 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.866 -0.607 . . . . 20.190000000000001 110.479 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -95.24 23.62 5.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.821 -0.627 . . . . 21.420000000000002 109.46 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -134.8 26.9 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.28 -0.873 . . . . 18.199999999999999 109.73 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -84.29 96.96 9.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.67 -0.695 . . . . 16.059999999999999 110.447 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -158.29 146.29 18.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.082 -0.508 . . . . 13.27 109.789 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -118.45 163.62 16.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.446 -0.343 . . . . 12.33 110.379 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -131.56 150.67 52.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.516 -0.311 . . . . 11.33 110.713 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.3 p -104.8 129.18 53.12 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.991 -0.55 . . . . 7.9500000000000002 110.011 175.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 21.4 m -85.75 -16.44 38.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.0 0.429 . . . . 7.3600000000000003 110.573 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 79.56 -60.98 4.29 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.876 -0.602 . . . . 4.5700000000000003 112.187 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -84.46 45.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.945 0.403 . . . . 4.5199999999999996 110.646 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 30' ' ' LYS . 54.9 tpp -160.94 119.01 2.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 2.0 110.127 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -81.53 146.15 30.32 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.288 -0.414 . . . . 1.47 110.178 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.403 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 97.9 mttt -121.39 161.59 21.86 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.324 -0.235 . . . . 3.1499999999999999 110.396 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -54.22 -52.6 60.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 2.3500000000000001 111.598 -174.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.492 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 68.4 mm-40 -73.88 -0.13 15.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.621 0.6 . . . . 4.1600000000000001 112.621 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -91.99 -20.47 21.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 2.5699999999999998 110.407 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.35 138.69 74.89 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.556 -0.905 . . . . 0.68999999999999995 108.556 176.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -45.31 112.96 0.44 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.15 2.567 . . . . 0.59999999999999998 112.697 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.02 67.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.732 -0.667 . . . . 0.56999999999999995 111.471 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -65.25 -35.33 80.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 122.238 1.018 . . . . 1.3700000000000001 109.283 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.415 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 84.8 t80 -83.92 -28.43 27.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.119 -1.4 . . . . 0.80000000000000004 110.617 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 53.1 mtp180 -70.0 -18.73 63.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.556 0.693 . . . . 1.73 109.732 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -21.18 63.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.62 -1.173 . . . . 1.02 110.206 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.3 mt -94.05 -26.44 16.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.925 -0.58 . . . . 0.93000000000000005 110.636 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.8 mtt -62.22 124.93 84.31 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 1.1499999999999999 110.462 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.38 151.27 65.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.226 1.951 . . . . 0.90000000000000002 112.529 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.405 ' HD3' ' CD2' ' A' ' 138' ' ' PHE . 88.0 Cg_exo -48.89 -50.09 13.5 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 122.851 2.367 . . . . 0.95999999999999996 112.197 -177.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -77.21 42.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.924 -1.035 . . . . 1.8300000000000001 111.355 -178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -156.79 -38.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.022 -0.99 . . . . 0.81999999999999995 108.596 175.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -67.03 -32.09 73.07 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.34 -0.845 . . . . 2.1600000000000001 110.289 173.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -50.29 -46.91 55.57 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.766 0.666 . . . . 1.0600000000000001 111.477 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 43.1 t80 -58.43 -61.47 2.56 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 119.175 -0.44 . . . . 0.65000000000000002 111.589 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.52 HD21 ' HE1' ' A' ' 100' ' ' TYR . 32.2 mt -73.33 -9.4 58.66 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 119.614 1.097 . . . . 1.1299999999999999 112.254 -179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.61 -40.23 80.51 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.683 -0.488 . . . . 2.0600000000000001 109.683 163.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -72.34 -54.1 10.44 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.628 -0.714 . . . . 1.8400000000000001 110.881 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.6 mm? -53.94 126.58 22.95 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.434 0.635 . . . . 1.05 110.461 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -112.39 -73.59 0.66 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.027 -0.988 . . . . 1.78 111.17 -170.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 3.4 p-10 -140.03 -86.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.587 0.217 . . . . 2.3900000000000001 111.587 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.413 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -63.01 -14.17 51.7 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 121.475 -0.393 . . . . 0.93000000000000005 112.708 -178.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.0 OUTLIER -65.93 -38.07 87.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.286 0.565 . . . . 2.25 109.802 176.728 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HB2' ' SD ' ' A' ' 0' ' ' MET . 76.5 mttt -77.26 -9.31 58.72 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.443 0.64 . . . . 1.3100000000000001 110.732 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 91.3 m -63.78 -45.81 88.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.32 -0.854 . . . . 0.80000000000000004 109.801 172.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.598 HG12 ' O ' ' A' ' 29' ' ' ASP . 1.8 p -75.97 -32.77 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 114.837 -1.074 . . . . 0.84999999999999998 110.406 -173.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.584 HD13 HD21 ' A' ' 52' ' ' LEU . 4.5 mm? -53.55 -52.92 58.16 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.245 -0.434 . . . . 0.97999999999999998 111.443 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 7.7 ptpp? -66.78 -23.68 66.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.553 -0.294 . . . . 2.4100000000000001 111.573 -175.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.9 mm-40 -72.53 -31.09 65.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.578 0.228 . . . . 1.96 110.796 176.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.8 t -74.06 -53.06 18.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.966 0.888 . . . . 0.97999999999999998 109.758 174.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.3 m-85 -56.47 -42.13 77.71 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 114.628 1.344 . . . . 0.82999999999999996 114.628 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 34' ' ' LYS . 9.5 mtmp? -79.94 7.53 8.72 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.129 -0.628 . . . . 2.1800000000000002 111.197 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -103.1 -77.18 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.513 -0.767 . . . . 1.5600000000000001 109.531 170.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 48.55 -157.48 1.03 Allowed Glycine 0 CA--C 1.523 0.566 0 C-N-CA 120.902 -0.666 . . . . 1.54 112.964 -174.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 11.7 Cg_endo -91.31 139.69 10.64 Favored 'Cis proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.287 -1.13 . . . . 1.6799999999999999 111.288 -8.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 44.8 m-85 -110.07 112.24 24.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.5 0.667 . . . . 1.28 111.281 -173.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -72.71 -14.28 61.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.529 -1.214 . . . . 3.5099999999999998 111.808 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.462 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -145.19 151.78 38.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.814 0.34 . . . . 1.52 111.524 -173.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.7 m -77.97 64.38 3.17 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.919 0.866 . . . . 1.1799999999999999 110.122 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.462 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 28.0 tt0 -156.72 -43.54 0.07 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.9 -1.045 . . . . 2.2400000000000002 108.724 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.419 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.7 mm-40 -59.0 -38.89 80.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.416 -0.811 . . . . 2.2599999999999998 111.012 174.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 m -65.28 -39.56 92.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 1.1899999999999999 110.02 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.0 -42.1 91.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 0.55000000000000004 110.335 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.37 -49.62 73.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.788 -1.097 . . . . 0.56999999999999995 111.307 175.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.97 88.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.431 0.634 . . . . 0.5 110.294 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.584 HD21 HD13 ' A' ' 33' ' ' LEU . 36.6 mt -65.49 -41.53 93.16 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.16 -0.927 . . . . 0.45000000000000001 111.053 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.35 -38.22 83.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.898 0.38 . . . . 1.22 111.072 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -68.38 -40.86 81.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.599 -0.728 . . . . 3.0499999999999998 111.387 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HD2' HG22 ' A' ' 32' ' ' VAL . 39.3 mttm -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.862 0.363 . . . . 1.48 111.533 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -138.68 99.58 8.46 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.339 -0.615 . . . . 1.1599999999999999 109.339 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -46.3 -52.28 7.48 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.992 3.128 . . . . 0.57999999999999996 112.991 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.87 -34.56 78.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.94 -1.027 . . . . 2.4500000000000002 112.233 -178.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.8 mt -74.89 -39.67 61.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.103 -1.039 . . . . 1.4199999999999999 109.774 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.03 -39.0 96.08 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 114.76 -1.109 . . . . 0.37 111.549 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.3 89.3 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.125 -0.324 . . . . 0.47999999999999998 110.125 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -56.58 -57.38 12.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.581 -0.736 . . . . 2.1699999999999999 110.761 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -65.74 -30.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 1.1200000000000001 111.043 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.99 -60.46 3.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.399 -0.364 . . . . 1.7 110.964 178.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.39 -32.58 73.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.593 0.711 . . . . 3.96 110.213 -174.602 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.533 ' O ' HG23 ' A' ' 70' ' ' VAL . 8.4 tp -67.84 -45.57 74.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.993 -1.003 . . . . 1.5 111.818 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -79.99 -18.99 48.85 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.062 -0.718 . . . . 2.3399999999999999 109.062 -175.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.99 85.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.004 -0.998 . . . . 0.40000000000000002 110.521 173.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.49 ' O ' ' HE2' ' A' ' 73' ' ' LYS . 30.8 mtm -59.47 -45.58 91.24 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.443 0.639 . . . . 0.71999999999999997 109.629 175.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 66' ' ' LEU . 60.8 t -56.04 -40.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.028 -0.987 . . . . 0.79000000000000004 110.548 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -67.27 -31.71 72.22 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.844 -0.616 . . . . 1.47 111.83 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.6 m -55.35 -41.93 73.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.009 0.433 . . . . 1.26 110.713 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 69' ' ' MET . 3.0 mmtt -71.06 -43.59 67.5 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 1.54 110.182 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 74.1 mt -70.63 -21.14 22.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.4 0.619 . . . . 0.34000000000000002 110.898 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.74 43.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.744 0.783 . . . . 0.34999999999999998 109.547 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 0.26 57.15 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.538 -1.21 . . . . 0.48999999999999999 110.324 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 77' ' ' LEU . 9.1 tp -93.07 133.04 36.63 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.70999999999999996 109.818 -175.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.16 158.86 50.35 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.998 -0.62 . . . . 0.76000000000000001 111.852 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.71 -34.99 22.38 Favored 'Trans proline' 0 N--CA 1.474 0.359 0 C-N-CA 123.611 2.874 . . . . 1.5600000000000001 113.798 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -65.33 -55.0 20.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.06 0.457 . . . . 2.52 110.187 -178.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.3 -29.54 38.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.628 -0.714 . . . . 0.35999999999999999 111.168 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.8 ttmt -56.5 -45.9 80.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.963 -0.562 . . . . 2.04 111.017 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.4 -42.07 98.79 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.792 -0.718 . . . . 0.40999999999999998 111.928 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 16.9 t80 -66.06 -44.62 84.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.196 . . . . 1.6499999999999999 111.12 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.1 79.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.389 -0.369 . . . . 0.40999999999999998 111.403 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 26.1 mt-10 -72.35 -35.31 68.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.813 -0.355 . . . . 1.96 110.744 -178.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -66.52 -50.31 63.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.238 -0.437 . . . . 2.1200000000000001 110.402 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.5 p -67.14 -38.92 86.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 0.56999999999999995 111.485 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.1 mp -57.23 -39.72 69.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.334 -0.394 . . . . 1.0900000000000001 111.205 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 63.6 mt-10 -72.31 -30.61 64.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.694 0.283 . . . . 2.8199999999999998 111.064 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.2 mt -74.59 -55.42 12.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.75 0.31 . . . . 0.51000000000000001 110.614 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.2 -50.24 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.944 -0.571 . . . . 0.64000000000000001 111.22 -178.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.99 -12.96 61.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.944 -0.571 . . . . 4.4199999999999999 110.971 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.73 -28.89 56.22 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.446 -0.662 . . . . 0.66000000000000003 111.446 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -62.7 -49.89 81.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.031 0.443 . . . . 0.55000000000000004 110.628 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.1 OUTLIER -83.1 4.08 27.9 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.258 -0.428 . . . . 2.7000000000000002 110.611 177.674 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.701 ' HA ' ' CD2' ' A' ' 100' ' ' TYR . . . -89.08 -33.95 16.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.175 -0.466 . . . . 0.63 110.03 172.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.415 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 5.7 ptp180 -86.85 5.46 36.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.407 -0.59 . . . . 3.1000000000000001 109.407 174.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -85.33 -37.72 19.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.304 -0.862 . . . . 0.96999999999999997 109.323 163.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.701 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 26.8 m-85 -57.36 -40.89 79.03 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.273 0.559 . . . . 1.48 111.201 -176.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.0 p -66.39 -8.31 24.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.055 -0.975 . . . . 0.87 112.687 -172.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 96.57 2.49 60.04 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.665 -0.778 . . . . 1.1599999999999999 111.265 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -95.43 171.01 8.96 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.356 -0.609 . . . . 1.8300000000000001 109.356 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -138.66 110.07 8.02 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 116.627 -0.26 . . . . 1.75 110.873 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.415 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 19.5 Cg_endo -61.72 143.22 96.15 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.284 1.989 . . . . 0.53000000000000003 111.002 173.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.456 ' O ' HD13 ' A' ' 110' ' ' LEU . 48.3 p -75.97 165.27 25.22 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.669 -0.493 . . . . 1.48 109.669 178.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -64.18 -22.39 66.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.861 -0.736 . . . . 2.8799999999999999 109.972 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 111' ' ' LYS . 38.2 m-20 -72.83 -35.68 67.33 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.23 -0.441 . . . . 2.2400000000000002 110.365 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -60.51 -42.3 96.11 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.253 -0.647 . . . . 1.73 109.253 173.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 106' ' ' THR . 7.1 mp -65.23 -46.73 79.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 114.987 -1.006 . . . . 0.81999999999999995 110.704 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 108' ' ' ASP . 50.1 mtpt -55.47 -48.24 74.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.347 -0.388 . . . . 1.74 110.558 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.431 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -62.37 -42.38 99.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.46999999999999997 111.455 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.497 ' O ' HG13 ' A' ' 117' ' ' VAL . 81.1 p -62.02 -38.59 89.25 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.312 0.486 . . . . 1.3400000000000001 112.312 -176.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.566 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.7 m -83.21 -23.39 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 122.031 0.92 . . . . 0.65000000000000002 109.454 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' HB1' ' A' ' 152' ' ' ALA . 36.8 ttpt -68.44 -48.74 63.78 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.451 -1.249 . . . . 1.72 111.185 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.54 ' O ' HD23 ' A' ' 120' ' ' LEU . 7.8 mm-40 -65.21 -35.91 82.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 2.27 110.829 -177.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -68.12 -26.86 35.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.662 -0.415 . . . . 0.81000000000000005 110.269 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.546 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 73.8 mt -73.44 -37.73 65.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.537 -0.542 . . . . 1.21 109.537 171.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.5 ttpt -57.11 -46.41 82.64 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 109.197 -0.668 . . . . 0.94999999999999996 109.197 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.3 mm? -63.21 -55.36 25.67 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.496 -0.774 . . . . 1.0600000000000001 111.68 170.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 17.5 t80 -67.86 -36.04 79.6 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 119.626 -0.83 . . . . 1.54 111.936 -166.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -64.11 -25.07 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.668 0.271 . . . . 1.98 111.464 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -93.45 -5.14 49.92 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.633 0.605 . . . . 0.69999999999999996 112.633 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.473 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 51.5 mtm -74.7 157.39 35.37 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.1 -0.64 . . . . 0.5 111.21 -178.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 3.6 m -59.78 151.79 24.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.167 -0.469 . . . . 1.1799999999999999 110.134 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -61.38 -40.71 95.33 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.726 -0.389 . . . . 2.21 110.757 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.96 74.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.381 . . . . 0.41999999999999998 110.683 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.66 -36.84 67.46 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 0.31 111.558 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' A' ' 124' ' ' MET . 96.6 mttt -66.08 -43.95 85.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.13 0.49 . . . . 1.3200000000000001 110.391 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.4 -35.92 81.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.41999999999999998 111.346 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.481 ' OD1' ' HD2' ' A' ' 134' ' ' LYS . 35.9 t70 -74.71 -27.97 60.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.268 0.556 . . . . 0.55000000000000004 110.069 -176.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.79 -30.63 71.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.078 -0.51 . . . . 0.39000000000000001 110.158 171.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.453 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -70.21 -26.02 74.82 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.27000000000000002 113.929 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.481 ' HD2' ' OD1' ' A' ' 131' ' ' ASP . 15.1 ptpt -85.86 -32.12 21.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.256 0.55 . . . . 2.4300000000000002 111.235 -178.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.413 ' CG ' HD13 ' A' ' 77' ' ' LEU . 36.2 mm-40 -88.17 -41.78 12.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.676 -0.693 . . . . 1.8300000000000001 110.658 -178.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.37 75.63 61.51 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-O 120.876 0.369 . . . . 0.68999999999999995 110.465 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -62.68 -41.73 29.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.166 2.578 . . . . 0.63 112.713 -174.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.497 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 46.2 t80 -58.29 -44.8 88.67 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.151 -0.477 . . . . 2.3100000000000001 111.1 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.79 -42.27 50.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.422 -0.353 . . . . 1.02 110.878 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.453 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.63 -40.75 84.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.34999999999999998 109.94 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 85.9 tttt -46.83 -68.43 0.19 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.947 -1.024 . . . . 2.5800000000000001 111.26 172.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.429 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.0 m -62.83 -28.55 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.646 -0.706 . . . . 0.5 112.637 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -73.09 -49.75 26.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.017 -0.673 . . . . 0.62 110.633 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.4 -32.54 66.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.596 -0.275 . . . . 2.5800000000000001 111.463 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.4 t -71.4 -26.68 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.198 0.523 . . . . 1.3200000000000001 110.52 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.05 7.02 56.66 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.604 -0.808 . . . . 1.0900000000000001 112.226 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -63.35 -48.95 75.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.911 0.386 . . . . 1.98 110.554 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.0 -34.97 71.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.34000000000000002 110.091 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.546 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -58.58 -54.25 49.15 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.57 -0.741 . . . . 0.51000000000000001 110.466 177.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.34 -41.76 63.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 2.8199999999999998 111.374 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -55.7 -46.2 77.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.48999999999999999 111.269 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.511 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.17 -10.0 55.55 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.925 0.713 . . . . 0.58999999999999997 112.925 -176.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 83.95 28.04 35.8 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.15 -1.024 . . . . 1.6200000000000001 110.845 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 20.7 tt0 71.66 175.36 0.29 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.064 0.946 . . . . 4.1200000000000001 110.46 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.433 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 48.1 t30 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.644 -0.693 . . . . 4.0099999999999998 110.068 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 15.6 tpt . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 120.778 0.323 . . . . 23.59 110.146 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 133.24 144.92 5.29 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.794 -0.717 . . . . 22.469999999999999 111.845 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 16.9 m -119.22 -5.27 10.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.733 0.301 . . . . 21.510000000000002 110.999 -178.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 14.8 m -85.09 47.78 1.46 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.527 -0.306 . . . . 20.190000000000001 111.553 -174.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -160.47 23.49 0.15 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.01 0.433 . . . . 21.420000000000002 111.365 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -118.99 63.59 0.78 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.511 0.672 . . . . 18.199999999999999 109.24 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -138.9 121.32 16.07 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.81 -0.632 . . . . 16.059999999999999 110.967 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -7' ' ' HIS . . . . . 0.515 ' HA ' ' OG ' ' A' ' -3' ' ' SER . 40.5 t-80 52.18 79.61 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.617 -0.72 . . . . 13.27 112.379 170.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 47.2 m170 -113.86 -84.8 0.6 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.958 -0.297 . . . . 12.33 111.147 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -143.79 14.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.897 0.38 . . . . 11.33 111.247 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.6 m -131.2 29.89 4.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.23 -0.441 . . . . 7.9500000000000002 110.152 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' SER . . . . . 0.515 ' OG ' ' HA ' ' A' ' -7' ' ' HIS . 15.4 m -85.76 -178.71 6.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.907 -0.588 . . . . 7.3600000000000003 110.455 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 94.93 40.17 4.41 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.037 -0.825 . . . . 4.5700000000000003 111.037 -175.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -84.47 -43.88 14.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.794 0.33 . . . . 4.5199999999999996 110.62 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -151.79 104.4 3.02 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.148 -0.478 . . . . 2.0 110.045 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.742 ' HA ' ' OE1' ' A' ' 4' ' ' GLU . 50.9 t80 -49.34 110.11 0.34 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.117 -0.947 . . . . 1.47 111.514 179.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -102.57 38.67 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.688 . . . . 3.1499999999999999 109.527 178.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.637 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 0.4 OUTLIER 58.09 22.2 8.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.04 -1.467 . . . . 2.3500000000000001 107.04 -159.117 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.742 ' OE1' ' HA ' ' A' ' 1' ' ' PHE . 12.0 mm-40 40.92 28.48 0.05 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 112.623 -2.08 . . . . 4.1600000000000001 115.076 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 43.08 34.19 0.62 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.209 0.528 . . . . 2.5699999999999998 110.733 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 3' ' ' TYR . 99.7 mt -53.29 134.44 51.57 Favored Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 115.887 -0.597 . . . . 0.68999999999999995 111.405 -174.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -36.23 113.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.035 3.157 . . . . 0.59999999999999998 112.694 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.07 -15.82 57.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.56 -0.746 . . . . 0.56999999999999995 111.227 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.97 -34.41 77.7 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.243 1.02 . . . . 1.3700000000000001 108.903 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -88.81 -33.09 17.54 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 113.58 -1.646 . . . . 0.80000000000000004 111.122 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.438 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 32.3 mtm180 -68.61 -27.79 66.34 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.25 -0.648 . . . . 1.73 109.25 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.39 -36.15 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.16 -0.927 . . . . 1.02 110.594 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.66 -36.06 60.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.627 -0.715 . . . . 0.93000000000000005 110.356 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 71.5 mtm -67.74 133.53 92.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.872 -0.603 . . . . 1.1499999999999999 111.41 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.45 ' HB2' ' OE2' ' A' ' 17' ' ' GLU . 72.2 Cg_endo -76.99 163.83 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.577 2.185 . . . . 0.90000000000000002 112.075 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.59 -44.23 17.49 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 123.085 2.523 . . . . 0.95999999999999996 113.229 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.1 pm0 -71.79 9.23 0.94 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.752 0.649 . . . . 1.8300000000000001 112.752 -176.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.06 -21.76 4.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.913 0.387 . . . . 0.81999999999999995 110.736 172.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 63.9 mtp180 -91.89 -44.48 8.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.043 -0.526 . . . . 2.1600000000000001 110.625 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 13.3 t70 -50.15 -50.9 47.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.544 -0.753 . . . . 1.0600000000000001 111.253 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.559 ' O ' HD23 ' A' ' 25' ' ' LEU . 41.1 t80 -52.56 -62.14 1.83 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.65000000000000002 111.799 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 1' ' ' PHE . 13.0 mt -74.59 -6.95 51.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 118.667 0.667 . . . . 1.1299999999999999 111.05 -175.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.44 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 61.0 tp60 -75.36 -43.27 51.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.17 0.51 . . . . 2.0600000000000001 110.739 163.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -64.97 -47.63 76.9 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.583 -0.735 . . . . 1.8400000000000001 111.842 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.559 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.7 mm? -53.34 132.72 39.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.48 0.657 . . . . 1.05 110.435 177.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -114.1 -72.23 0.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.984 -1.007 . . . . 1.78 112.083 -173.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -140.11 -82.95 0.25 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.624 -0.43 . . . . 2.3900000000000001 111.802 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.81 -29.89 71.47 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 121.464 -0.398 . . . . 0.93000000000000005 113.395 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.43 -6.83 50.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.812 0.339 . . . . 2.25 111.12 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.545 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 92.4 mttt -89.48 -24.81 21.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.228 0.537 . . . . 1.3100000000000001 109.864 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.5 m -62.34 -33.68 75.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.309 -0.86 . . . . 0.80000000000000004 111.008 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.681 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 4.4 p -75.38 -32.11 25.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.537 -0.301 . . . . 0.84999999999999998 111.713 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.425 HD12 ' CE2' ' A' ' 37' ' ' PHE . 4.0 mm? -49.88 -51.87 37.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.867 0.321 . . . . 0.97999999999999998 111.867 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 63.6 pttt -64.25 -33.04 74.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.758 0.313 . . . . 2.4100000000000001 110.832 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -65.86 -24.7 66.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.509 . . . . 1.96 110.735 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -91.98 -44.43 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.992 -0.549 . . . . 0.97999999999999998 110.587 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 33' ' ' LEU . 18.9 m-85 -55.14 -34.49 63.81 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.748 0.647 . . . . 0.82999999999999996 112.748 173.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -93.15 7.64 43.42 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.087 -0.645 . . . . 2.1800000000000002 110.921 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.57 12.23 22.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.975 -0.557 . . . . 1.5600000000000001 110.375 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.85 -158.48 19.44 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.88 -0.676 . . . . 1.54 112.181 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.64 163.58 87.93 Favored 'Cis proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.935 -1.277 . . . . 1.6799999999999999 112.754 0.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.571 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 45.9 m-85 -121.57 134.78 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.186 -0.915 . . . . 1.28 109.599 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -81.02 -12.02 59.44 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.872 -0.604 . . . . 3.5099999999999998 110.482 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -161.0 165.03 30.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.703 -0.681 . . . . 1.52 110.191 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.9 m -64.62 -29.59 70.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.222 0.326 . . . . 1.1799999999999999 111.09 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -53.1 -43.85 67.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.086 -0.506 . . . . 2.2400000000000002 111.402 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.571 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 29.5 mt-10 -59.43 -42.11 91.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.201 -0.454 . . . . 2.2599999999999998 111.215 177.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.6 t -66.32 -39.62 89.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.32 -0.4 . . . . 1.1899999999999999 110.158 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.81 -41.98 93.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.54 . . . . 0.55000000000000004 110.19 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.9 -50.09 74.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.164 -0.926 . . . . 0.56999999999999995 111.286 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.94 -39.58 74.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.5 110.771 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 29.9 mt -69.24 -40.23 78.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.636 -0.711 . . . . 0.45000000000000001 111.03 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -63.38 -31.16 72.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.774 0.321 . . . . 1.22 111.779 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.82 -38.16 70.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.176 -0.465 . . . . 3.0499999999999998 111.061 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.681 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 5.2 tppt? -85.8 -56.02 3.69 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.994 0.426 . . . . 1.48 110.835 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.9 m -127.57 90.72 47.63 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.854 -0.612 . . . . 1.1599999999999999 109.515 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.66 -55.41 3.58 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 124.31 3.34 . . . . 0.57999999999999996 113.196 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -63.54 -32.96 74.57 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 114.603 -1.18 . . . . 2.4500000000000002 112.084 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.7 -39.63 66.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.049 0.928 . . . . 1.4199999999999999 108.759 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.82 88.3 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.124 -1.398 . . . . 0.37 111.436 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.32 -32.24 72.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.817 0.341 . . . . 0.47999999999999998 110.662 175.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -66.96 -51.87 49.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 2.1699999999999999 110.908 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.94 -24.23 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 120.851 0.358 . . . . 1.1200000000000001 110.684 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -65.1 -59.29 4.28 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.257 -0.429 . . . . 1.7 110.792 177.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -34.84 77.63 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.534 0.683 . . . . 3.96 109.444 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 17' ' ' GLU . 18.0 tp -67.62 -30.35 69.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.691 -1.14 . . . . 1.5 110.657 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -83.58 -37.0 23.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 109.083 -0.71 . . . . 2.3399999999999999 109.083 -177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.92 83.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.039 -0.982 . . . . 0.40000000000000002 110.354 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 17' ' ' GLU . 31.9 mtp -53.6 -57.96 8.88 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.354 0.597 . . . . 0.71999999999999997 110.363 173.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 66' ' ' LEU . 82.9 t -56.07 -44.85 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 114.794 -1.094 . . . . 0.79000000000000004 110.881 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -64.63 -42.44 95.47 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 116.053 -0.522 . . . . 1.47 111.698 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.9 m -59.21 -35.26 73.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.168 0.509 . . . . 1.26 110.89 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 88.7 mttt -78.1 -46.7 20.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.729 -0.669 . . . . 1.54 110.552 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.2 mt -66.25 -17.22 22.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 121.844 0.83 . . . . 0.34000000000000002 110.379 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.16 -34.72 56.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.986 -1.006 . . . . 0.34999999999999998 110.035 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -85.35 -1.32 56.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.811 -1.086 . . . . 0.48999999999999999 110.17 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 132' ' ' PHE . 7.8 tp -96.57 138.64 33.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.544 -0.753 . . . . 0.70999999999999996 110.417 -175.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.56 152.8 52.44 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.72 -0.752 . . . . 0.76000000000000001 111.934 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -41.15 -44.99 5.42 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 124.392 3.395 . . . . 1.5600000000000001 114.368 -176.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.52 ' H ' ' CD ' ' A' ' 80' ' ' GLU . 1.0 OUTLIER -69.19 -44.31 72.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 2.52 111.239 -175.846 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.436 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -77.29 -32.52 55.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.553 0.692 . . . . 0.35999999999999999 109.817 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -52.33 -51.62 57.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.373 -1.285 . . . . 2.04 111.651 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.84 -40.8 95.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.014 -0.612 . . . . 0.40999999999999998 112.363 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 14.6 t80 -68.98 -44.1 73.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.391 0.139 . . . . 1.6499999999999999 110.883 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -58.05 -37.33 74.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.977 0.418 . . . . 0.40999999999999998 111.046 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 44.2 mt-10 -68.14 -48.33 65.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.059 -0.519 . . . . 1.96 110.279 178.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 91' ' ' ILE . 47.2 mttm -66.05 -44.19 85.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.346 0.498 . . . . 2.1200000000000001 112.346 -178.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.404 ' HA ' HG12 ' A' ' 117' ' ' VAL . 11.8 p -59.79 -45.85 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.86 0.362 . . . . 0.56999999999999995 110.998 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.6 mp -60.36 -41.88 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.013 -0.539 . . . . 1.0900000000000001 110.648 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 46.4 mt-10 -64.24 -52.83 56.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.654 0.242 . . . . 2.8199999999999998 111.654 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.515 HG22 ' OG ' ' A' ' 113' ' ' SER . 70.6 mt -60.51 -43.85 95.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 120.868 0.366 . . . . 0.51000000000000001 111.279 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.4 -46.24 73.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.079 0.466 . . . . 0.64000000000000001 111.17 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -68.65 -25.97 65.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.445 -0.343 . . . . 4.4199999999999999 111.781 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.64 -36.3 75.7 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.852 -0.69 . . . . 0.66000000000000003 112.024 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 mm -58.91 -41.32 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.009 0.433 . . . . 0.55000000000000004 111.145 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.491 ' HD3' ' N ' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -96.5 17.88 15.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.117 0.484 . . . . 2.7000000000000002 110.707 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -102.22 -34.54 9.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.604 -0.725 . . . . 0.63 109.06 169.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 8.1 ptm180 -83.63 -3.23 57.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 3.1000000000000001 109.954 174.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.511 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -80.27 -40.08 27.64 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.491 -0.559 . . . . 0.96999999999999997 109.491 164.396 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.413 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 2.9 m-85 -68.56 -32.44 72.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.605 -0.725 . . . . 1.48 111.985 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.3 p -65.46 -15.08 62.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.87 112.06 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 107.68 10.68 26.42 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 121.11 -0.567 . . . . 1.1599999999999999 111.816 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 87.5 m-20 -108.53 169.22 8.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.882 -0.414 . . . . 1.8300000000000001 109.882 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.49 ' OE1' ' HB2' ' A' ' -3' ' ' SER . 38.7 mt-10 -133.15 104.83 12.43 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 121.19 -0.204 . . . . 1.75 111.302 177.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.8 Cg_endo -60.38 139.53 87.08 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 121.744 1.63 . . . . 0.53000000000000003 110.647 171.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.449 HG22 ' OD2' ' A' ' 109' ' ' ASP . 11.4 t -83.97 176.64 8.72 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.799 -0.445 . . . . 1.48 109.799 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.6 pptp? -63.81 -25.79 68.33 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.511 -0.476 . . . . 2.8799999999999999 110.644 -176.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.87 -35.44 80.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.903 -0.59 . . . . 2.2400000000000002 110.01 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.449 ' OD2' HG22 ' A' ' 106' ' ' THR . 20.6 m-20 -63.96 -45.69 88.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 1.73 110.587 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -66.38 -43.89 84.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.81999999999999995 110.58 178.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 23.9 ttmm -59.38 -42.95 92.87 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.193 -0.458 . . . . 1.74 110.426 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 116' ' ' GLU . . . -68.01 -42.41 80.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.471 -0.332 . . . . 0.46999999999999997 110.838 177.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.515 ' OG ' HG22 ' A' ' 91' ' ' ILE . 42.2 t -53.06 -50.26 64.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 1.3400000000000001 111.096 178.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' A' ' 152' ' ' ALA . 3.8 m -77.97 -26.24 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-O 121.534 0.683 . . . . 0.65000000000000002 109.639 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 62.9 tttm -60.44 -42.33 95.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.368 -0.833 . . . . 1.72 111.074 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 112' ' ' ALA . 29.8 mt-10 -73.39 -37.71 65.88 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.6 -0.44 . . . . 2.27 110.502 -177.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.73 -34.5 70.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.502 -0.479 . . . . 0.81000000000000005 110.39 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.532 HD23 ' O ' ' A' ' 114' ' ' VAL . 4.0 mm? -71.64 -35.24 70.33 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.062 -0.399 . . . . 1.21 110.225 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -59.31 -40.75 87.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.956 -0.757 . . . . 0.94999999999999996 108.956 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -71.9 -53.71 12.3 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.228 -0.896 . . . . 1.0600000000000001 111.792 172.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 72.2 t80 -69.53 -37.04 76.95 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 119.916 -0.714 . . . . 1.54 111.914 -165.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -68.66 -28.57 67.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 1.98 110.987 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.32 56.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 0.69999999999999996 112.136 -176.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 36.6 mtm -74.96 160.15 30.93 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.546 -0.461 . . . . 0.5 111.342 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.0 t -60.05 137.05 58.18 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.011 -0.737 . . . . 1.1799999999999999 109.011 172.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.5 -39.51 73.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.561 -0.745 . . . . 2.21 111.691 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.59 87.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.41999999999999998 110.606 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.78 66.33 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.639 -0.71 . . . . 0.31 111.46 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 129' ' ' LYS . 44.3 mtpt -64.96 -45.98 83.47 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.378 0.608 . . . . 1.3200000000000001 109.714 176.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.59 78.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.387 -0.824 . . . . 0.41999999999999998 110.529 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.405 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 38.2 t70 -74.16 -33.91 63.64 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.381 -0.6 . . . . 0.55000000000000004 109.381 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.486 ' HA ' HD11 ' A' ' 77' ' ' LEU . 82.6 t80 -62.31 -32.39 73.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.735 -0.666 . . . . 0.39000000000000001 110.343 171.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -70.39 -7.63 60.94 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.27000000000000002 112.945 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 79.2 mttt -88.94 -43.45 11.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.361 0.601 . . . . 2.4300000000000002 109.596 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.525 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.7 mp0 -86.34 -35.75 19.67 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.17 -0.923 . . . . 1.8300000000000001 111.304 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -133.95 74.8 68.11 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.218 0.532 . . . . 0.68999999999999995 110.441 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.92 -31.74 66.68 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 123.243 2.628 . . . . 0.63 112.926 -174.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' HG13 ' A' ' 142' ' ' VAL . 34.9 m-85 -61.88 -44.82 96.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.065 0.394 . . . . 2.3100000000000001 112.065 -177.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.404 HD21 ' HD3' ' A' ' 15' ' ' PRO . 65.6 mt -72.27 -43.72 63.88 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.506 -0.478 . . . . 1.02 110.191 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.25 -31.51 67.48 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.481 0.657 . . . . 0.34999999999999998 110.451 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 25.4 ttmm -61.54 -76.94 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.094 -0.957 . . . . 2.5800000000000001 111.664 173.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.553 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.0 OUTLIER -63.9 -24.35 35.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.173 -0.921 . . . . 0.5 112.636 -169.547 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -70.82 -41.62 71.32 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.799 -0.36 . . . . 0.62 110.47 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -81.6 -25.22 35.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.455 . . . . 2.5800000000000001 110.96 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.8 m -69.67 -8.72 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.03 0.443 . . . . 1.3200000000000001 110.513 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 88.64 -4.06 85.06 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.901 -0.591 . . . . 1.0900000000000001 113.099 175.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -69.12 -53.94 17.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.731 0.301 . . . . 1.98 111.193 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.406 ' HB1' HD21 ' A' ' 118' ' ' LEU . . . -65.0 -39.64 93.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.409 -0.36 . . . . 0.34000000000000002 110.603 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.44 -42.76 88.07 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.158 -0.474 . . . . 0.51000000000000001 110.512 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -62.5 -41.7 99.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.826 0.346 . . . . 2.8199999999999998 110.372 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -62.71 -34.86 78.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.942 -0.572 . . . . 0.48999999999999999 110.332 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.558 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.48 -34.24 41.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.58999999999999997 111.946 -178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 109.18 26.61 5.13 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.22 -0.752 . . . . 1.6200000000000001 111.22 -174.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.56 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 29.3 tt0 67.87 174.58 0.27 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.063 0.945 . . . . 4.1200000000000001 110.272 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.56 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 18.9 m120 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.708 -0.663 . . . . 4.0099999999999998 109.935 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.508 0.194 . . . . 23.59 110.671 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 156.97 -102.74 0.22 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.296 -0.954 . . . . 22.469999999999999 112.199 178.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 14.0 t -86.81 91.38 8.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.124 0.487 . . . . 21.510000000000002 110.365 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 16.5 p -121.78 29.0 7.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.562 0.696 . . . . 20.190000000000001 109.731 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -80.56 103.23 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.351 -0.841 . . . . 21.420000000000002 110.163 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -56.49 -41.45 76.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.569 -0.741 . . . . 18.199999999999999 111.86 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -76.12 89.1 3.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.966 0.412 . . . . 16.059999999999999 110.874 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -88.9 86.06 6.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.232 -0.44 . . . . 13.27 110.955 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -86.25 76.42 9.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.835 -0.802 . . . . 12.33 108.835 174.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -85.2 95.98 9.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.793 -0.64 . . . . 11.33 110.664 -174.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 11.5 t -141.03 168.27 20.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.029 -0.532 . . . . 7.9500000000000002 109.815 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.1 p -60.28 125.81 25.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.943 -0.571 . . . . 7.3600000000000003 111.665 -177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 118.98 -8.23 12.67 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.863 -0.684 . . . . 4.5700000000000003 112.479 178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -121.49 2.67 10.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.816 0.341 . . . . 4.5199999999999996 111.318 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.435 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 21.7 ttm -158.23 91.42 1.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.032 -0.531 . . . . 2.0 109.991 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.467 ' CE1' ' HG3' ' A' ' 30' ' ' LYS . 18.6 p90 -65.21 156.88 30.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.839 -0.619 . . . . 1.47 111.435 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.527 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 68.5 mttm -118.09 157.0 27.67 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.745 -0.662 . . . . 3.1499999999999999 109.733 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -66.64 -18.08 65.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.464 0.649 . . . . 2.3500000000000001 109.736 175.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -84.24 -14.65 49.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.313 -0.858 . . . . 4.1600000000000001 110.847 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.527 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 5.5 m-20 -93.66 -6.03 47.28 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.294 0.569 . . . . 2.5699999999999998 110.414 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.1 mt -85.49 135.41 38.59 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.325 -0.852 . . . . 0.68999999999999995 108.952 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -46.24 114.26 0.81 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.199 2.599 . . . . 0.59999999999999998 112.583 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.97 67.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.56999999999999995 111.713 -176.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -63.86 -36.32 83.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.897 0.856 . . . . 1.3700000000000001 109.556 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -88.27 -19.03 27.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.097 -1.411 . . . . 0.80000000000000004 110.618 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -74.53 -25.49 59.37 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.502 0.668 . . . . 1.73 109.557 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.604 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 27.5 t70 -67.16 -25.16 66.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.066 -0.97 . . . . 1.02 110.36 173.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.445 HD21 ' HG3' ' A' ' 147' ' ' LYS . 98.2 mt -87.3 7.68 27.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.93000000000000005 111.013 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.536 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 67.1 mtt -93.79 122.06 63.09 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.452 -0.34 . . . . 1.1499999999999999 110.143 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.2 150.35 84.96 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.286 1.991 . . . . 0.90000000000000002 111.159 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -45.87 -45.19 17.53 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.009 2.473 . . . . 0.95999999999999996 113.246 -172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.89 -50.43 73.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.952 0.406 . . . . 1.8300000000000001 111.134 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.7 -37.08 70.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.81999999999999995 111.836 -174.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.536 ' HD2' ' O ' ' A' ' 14' ' ' MET . 14.0 ptm180 -76.91 -29.17 55.6 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 121.019 -0.273 . . . . 2.1600000000000001 111.071 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.49 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 27.9 t70 -56.39 -45.38 80.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.712 0.292 . . . . 1.0600000000000001 110.553 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 50.2 t80 -55.58 -60.35 3.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.07 -0.514 . . . . 0.65000000000000002 111.823 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.499 HD21 ' CE1' ' A' ' 100' ' ' TYR . 23.1 mt -73.45 -8.11 54.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 119.791 1.178 . . . . 1.1299999999999999 112.045 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 28.1 tt0 -69.07 -38.7 79.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.086 0.469 . . . . 2.0600000000000001 109.875 163.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -72.15 -54.23 10.32 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.808 -0.633 . . . . 1.8400000000000001 110.349 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -54.12 130.62 38.86 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.227 -0.897 . . . . 1.05 111.115 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 m -129.96 -82.34 0.55 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.508 -0.769 . . . . 1.78 110.994 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.54 154.59 43.03 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.546 -0.538 . . . . 2.3900000000000001 109.546 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -45.76 3.52 Favored Glycine 0 C--N 1.322 -0.225 0 C-N-CA 120.462 -0.875 . . . . 0.93000000000000005 111.694 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.51 -29.74 69.23 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 2.25 109.534 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HE3' ' HB3' ' A' ' 25' ' ' LEU . 1.5 mptm? -62.44 -18.07 60.85 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.008 -0.542 . . . . 1.3100000000000001 110.361 176.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.4 m -74.4 -45.48 46.45 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.757 -0.656 . . . . 0.80000000000000004 110.318 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.77 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 2.3 p -73.17 -41.77 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 120.281 -0.567 . . . . 0.84999999999999998 110.917 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.598 HD12 ' HE1' ' A' ' 37' ' ' PHE . 3.8 mm? -55.94 -35.57 66.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.623 0.249 . . . . 0.97999999999999998 110.837 175.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 64.2 tttm -70.27 -27.49 64.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.396 -0.365 . . . . 2.4100000000000001 111.243 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.26 -28.52 14.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.629 0.252 . . . . 1.96 111.676 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 39' ' ' ALA . 74.6 t -83.94 -28.12 7.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.153 0.501 . . . . 0.97999999999999998 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.598 ' HE1' HD12 ' A' ' 33' ' ' LEU . 15.0 m-85 -74.39 -24.94 59.2 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 113.895 1.072 . . . . 0.82999999999999996 113.895 165.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 71.7 mmtt -75.73 -17.81 59.79 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 106.815 -1.55 . . . . 2.1800000000000002 106.815 165.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 36' ' ' VAL . . . 70.16 -79.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 116.94 2.2 . . . . 1.5600000000000001 116.94 154.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.79 -72.34 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 118.628 -1.749 . . . . 1.54 114.09 -157.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -88.36 172.28 30.9 Favored 'Cis proline' 0 N--CA 1.461 -0.438 0 N-CA-C 115.081 1.147 . . . . 1.6799999999999999 115.081 7.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.546 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 15.4 m-85 -100.63 155.79 17.68 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.263 -1.335 . . . . 1.28 110.572 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -101.4 -12.01 18.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.72 -0.673 . . . . 3.5099999999999998 110.707 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -157.66 161.84 38.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.598 -0.274 . . . . 1.52 111.365 -177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.9 m -60.03 -35.16 74.5 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 123.223 0.327 . . . . 1.1799999999999999 111.287 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -49.56 -38.63 31.91 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.998 -0.547 . . . . 2.2400000000000002 112.135 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.546 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.3 mt-10 -70.25 -31.13 68.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.724 -0.217 . . . . 2.2599999999999998 111.434 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 t -72.72 -43.08 63.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.56 -0.534 . . . . 1.1899999999999999 109.56 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.39 -43.21 97.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.55000000000000004 109.785 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.9 -48.23 78.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.413 -0.812 . . . . 0.56999999999999995 111.139 173.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.92 86.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.448 0.642 . . . . 0.5 110.463 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 63' ' ' VAL . 30.0 mt -68.76 -40.17 79.89 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.957 -1.02 . . . . 0.45000000000000001 111.215 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -66.32 -22.22 66.27 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.562 -0.455 . . . . 1.22 111.218 177.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -84.4 -33.05 23.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 3.0499999999999998 110.758 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.77 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 22.8 tptp -90.57 -60.77 1.83 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.886 -0.597 . . . . 1.48 110.769 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.5 p -127.96 85.88 59.54 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 115.87 -0.604 . . . . 1.1599999999999999 109.713 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.32 -60.02 0.93 Allowed 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 124.051 3.167 . . . . 0.57999999999999996 113.747 -168.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.33 -26.06 68.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.649 -1.16 . . . . 2.4500000000000002 111.608 -176.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 52.7 tp -75.19 -39.48 60.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.655 0.741 . . . . 1.4199999999999999 109.546 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.18 -32.09 81.31 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.91 -1.041 . . . . 0.37 111.3 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -34.84 78.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.705 -0.247 . . . . 0.47999999999999998 110.606 174.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 57.8 mttp -61.53 -45.08 95.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.086 0.47 . . . . 2.1699999999999999 110.072 175.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.65 HG21 HD13 ' A' ' 52' ' ' LEU . 21.2 t -71.39 -38.51 69.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.859 -0.61 . . . . 1.1200000000000001 110.763 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.06 -44.01 90.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.486 . . . . 1.7 111.231 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -66.01 -40.55 91.21 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.079 -0.711 . . . . 3.96 109.079 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 21' ' ' PHE . 61.5 tp -65.25 -35.25 80.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.284 -0.871 . . . . 1.5 110.722 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -73.64 -39.63 64.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.46 -0.941 . . . . 2.3399999999999999 108.46 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.63 87.14 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.892 -1.049 . . . . 0.40000000000000002 110.624 176.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.414 ' SD ' ' HA ' ' A' ' 66' ' ' LEU . 21.5 mtp -61.64 -57.61 11.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.306 0.574 . . . . 0.71999999999999997 110.71 176.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 66' ' ' LEU . 87.4 t -58.69 -43.7 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 115.515 -0.766 . . . . 0.79000000000000004 110.708 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -64.51 -34.29 77.87 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.931 -0.577 . . . . 1.47 111.563 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 38.2 t -57.98 -48.9 78.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.084 0.469 . . . . 1.26 110.287 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.515 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 62.2 mttm -66.16 -47.73 73.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.559 -0.746 . . . . 1.54 110.529 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.64 -24.51 33.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.244 0.545 . . . . 0.34000000000000002 111.408 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.92 64.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.468 0.652 . . . . 0.34999999999999998 110.495 174.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.39 -2.54 58.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.191 -0.913 . . . . 0.48999999999999999 110.456 -178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.423 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.4 tp -95.45 130.51 42.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.686 -0.688 . . . . 0.70999999999999996 110.041 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.77 152.26 46.02 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.837 -0.696 . . . . 0.76000000000000001 112.11 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -40.21 -43.28 3.79 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 124.243 3.295 . . . . 1.5600000000000001 114.397 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -63.9 -44.63 92.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.886 0.374 . . . . 2.52 111.159 -176.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -86.07 -30.82 22.32 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.498 -0.481 . . . . 0.35999999999999999 110.411 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -57.89 -46.34 85.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.485 -0.779 . . . . 2.04 110.758 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.28 -41.06 94.78 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.885 -0.674 . . . . 0.40999999999999998 112.067 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.8 t80 -69.52 -46.38 66.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.981 -0.11 . . . . 1.6499999999999999 110.967 176.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.93 -47.16 78.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.118 0.485 . . . . 0.40999999999999998 111.267 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.3 mt-10 -65.73 -39.66 91.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.795 -0.638 . . . . 1.96 110.704 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -74.3 -42.11 60.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.516 -0.311 . . . . 2.1200000000000001 111.487 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.1 p -64.37 -39.36 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.912 0.387 . . . . 0.56999999999999995 110.168 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.33 -39.92 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.773 -0.649 . . . . 1.0900000000000001 110.215 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.629 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.5 mt-10 -66.48 -45.69 78.82 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 111.465 0.172 . . . . 2.8199999999999998 111.465 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.436 HG22 ' OG ' ' A' ' 113' ' ' SER . 68.9 mt -61.97 -43.15 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.959 0.409 . . . . 0.51000000000000001 110.546 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.04 -37.94 75.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.237 -0.438 . . . . 0.64000000000000001 110.015 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -60.05 -43.01 95.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 4.4199999999999999 110.964 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -63.74 -30.15 76.82 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 121.088 -0.577 . . . . 0.66000000000000003 112.496 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -68.0 -46.13 82.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.772 0.32 . . . . 0.55000000000000004 111.35 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -82.4 -17.78 44.25 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.576 -0.449 . . . . 2.7000000000000002 110.199 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.453 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . . . -61.86 -37.9 86.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.805 0.336 . . . . 0.63 110.446 171.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 11.7 ptm180 -89.92 7.81 35.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.086 -0.506 . . . . 3.1000000000000001 110.564 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.38 -41.15 9.15 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.65 -0.871 . . . . 0.96999999999999997 108.65 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.499 ' CE1' HD21 ' A' ' 22' ' ' LEU . 28.5 m-85 -61.98 -34.72 76.67 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.675 -0.693 . . . . 1.48 111.342 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.3 p -73.56 1.62 9.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.209 -0.45 . . . . 0.87 112.179 -178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.432 ' HA3' ' HE2' ' A' ' 34' ' ' LYS . . . 89.16 6.41 71.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.093 -0.575 . . . . 1.1599999999999999 112.356 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 80.4 m-20 -96.47 -176.8 3.74 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.049 -0.352 . . . . 1.8300000000000001 110.049 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.7 mt-10 -147.3 109.3 3.92 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.606 -0.27 . . . . 1.75 110.997 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 26.2 Cg_endo -64.14 157.31 54.28 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.823 2.349 . . . . 0.53000000000000003 112.162 174.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 74.4 p -81.31 171.4 14.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.753 -0.462 . . . . 1.48 109.753 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.96 -26.37 68.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.26 -0.644 . . . . 2.8799999999999999 109.26 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -67.78 -39.16 84.12 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.266 -0.879 . . . . 2.2400000000000002 110.611 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -59.39 -41.65 89.86 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.177 0.513 . . . . 1.73 110.448 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.443 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.8 mp -68.96 -45.03 71.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.81999999999999995 110.669 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 28.8 mtpp -57.63 -48.25 79.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.216 -0.447 . . . . 1.74 110.56 177.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.46999999999999997 110.989 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.508 ' O ' HG13 ' A' ' 117' ' ' VAL . 27.1 t -54.46 -49.63 69.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 1.3400000000000001 111.095 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.633 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.1 m -81.44 -22.58 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.765 0.793 . . . . 0.65000000000000002 109.951 -174.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 46.8 tttm -67.98 -45.68 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.784 -1.098 . . . . 1.72 111.138 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 15.1 mm-40 -70.69 -34.05 71.56 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.623 -0.431 . . . . 2.27 110.656 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.0 -31.89 55.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.616 -0.433 . . . . 0.81000000000000005 110.391 176.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -73.05 -36.27 66.86 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.051 -0.352 . . . . 1.21 110.051 175.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.422 ' HD2' HD12 ' A' ' 120' ' ' LEU . 2.2 ttmm -59.5 -48.02 83.26 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.026 -0.731 . . . . 0.94999999999999996 109.026 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -68.54 -45.51 71.96 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.876 -1.056 . . . . 1.0600000000000001 111.768 176.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 10.4 t80 -69.52 -37.04 76.96 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.274 -0.571 . . . . 1.54 111.643 -170.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -65.16 -27.78 68.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 1.98 111.395 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.41 -6.86 59.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.089 -0.505 . . . . 0.69999999999999996 112.055 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.6 mtm -76.4 153.95 35.27 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.5 110.382 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -65.8 150.25 48.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.64 -0.255 . . . . 1.1799999999999999 110.559 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -54.93 -46.56 74.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.217 0.451 . . . . 2.21 112.217 -171.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.31 -32.97 70.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.41999999999999998 110.926 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.14 -34.16 55.73 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.881 -0.6 . . . . 0.31 111.788 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -64.54 -45.88 85.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.076 0.465 . . . . 1.3200000000000001 110.359 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.59 -28.19 65.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.41999999999999998 110.86 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 15.8 t70 -77.31 -35.34 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.505 -0.554 . . . . 0.55000000000000004 109.505 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -60.57 -31.02 70.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.745 -0.661 . . . . 0.39000000000000001 110.297 172.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.76 -5.63 69.77 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.098 -0.572 . . . . 0.27000000000000002 113.248 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 77.6 mttt -94.74 -42.06 8.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.783 0.802 . . . . 2.4300000000000002 109.485 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.515 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.9 mp0 -80.96 -40.28 24.72 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.769 -1.105 . . . . 1.8300000000000001 110.968 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -130.87 72.88 81.63 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.052 0.453 . . . . 0.68999999999999995 110.713 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -65.47 -32.48 49.38 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.957 2.438 . . . . 0.63 112.964 -176.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.48 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 44.2 t80 -60.45 -41.77 94.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.916 0.389 . . . . 2.3100000000000001 110.554 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.41 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.1 mt -77.62 -42.84 33.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.245 -0.434 . . . . 1.02 110.533 -178.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.16 -34.58 72.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.058 0.456 . . . . 0.34999999999999998 110.215 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.7 tttp -52.91 -70.85 0.08 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.223 -0.899 . . . . 2.5800000000000001 111.477 171.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 3.4 m -62.5 -30.41 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.165 -0.925 . . . . 0.5 112.955 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.41 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.6 m-30 -67.1 -47.89 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.134 -0.626 . . . . 0.62 110.216 -179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -72.19 -38.59 69.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 2.5800000000000001 111.353 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 31.2 t -70.77 -20.68 62.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 1.3200000000000001 110.705 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 96.66 2.14 60.02 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.751 -0.738 . . . . 1.0900000000000001 112.372 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.604 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 44.3 tptt -56.98 -46.72 82.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.829 0.347 . . . . 1.98 110.853 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -77.89 -36.94 49.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.141 0.496 . . . . 0.34000000000000002 110.34 177.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.44 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -57.69 -46.95 83.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.533 -0.758 . . . . 0.51000000000000001 111.758 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -65.47 -35.49 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 2.8199999999999998 110.851 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -64.07 -35.37 80.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.304 0.573 . . . . 0.48999999999999999 109.872 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.598 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -78.69 -22.88 46.03 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.662 -0.699 . . . . 0.58999999999999997 111.683 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 92.48 22.61 28.66 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.277 -0.729 . . . . 1.6200000000000001 111.277 -174.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -96.39 -128.47 0.15 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.221 0.534 . . . . 4.1200000000000001 111.644 -175.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 C--O 1.246 0.886 0 CA-C-N 115.265 -0.879 . . . . 4.0099999999999998 111.373 -170.638 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 16.1 tpt . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.766 0.317 . . . . 23.59 110.454 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -156.38 -173.98 25.58 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.891 -0.671 . . . . 22.469999999999999 111.976 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 12.3 p -89.6 86.32 6.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.911 0.386 . . . . 21.510000000000002 110.82 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 30.7 t -70.98 -57.94 4.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.113 -0.494 . . . . 20.190000000000001 110.006 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -141.06 -66.47 0.42 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.836 -0.62 . . . . 21.420000000000002 109.868 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -170.58 -54.27 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.705 -0.679 . . . . 18.199999999999999 110.089 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 50.8 t60 -157.89 146.27 19.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 16.059999999999999 109.941 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -79.85 97.84 6.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.496 -0.32 . . . . 13.27 110.34 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -85.76 -70.37 0.6 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.939 0.4 . . . . 12.33 110.734 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -82.41 -12.05 58.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.128 -0.487 . . . . 11.33 110.51 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 18.3 m 66.07 28.27 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.726 -0.67 . . . . 7.9500000000000002 111.837 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 50.3 m -83.53 88.41 7.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.072 0.463 . . . . 7.3600000000000003 110.525 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -76.1 111.29 3.26 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.898 -0.668 . . . . 4.5700000000000003 111.736 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -72.3 95.64 1.74 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.986 0.422 . . . . 4.5199999999999996 110.252 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 84.9 mmm -93.44 136.66 33.49 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 2.0 109.706 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -73.97 146.39 43.92 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.97 -0.559 . . . . 1.47 110.541 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' ILE . 33.6 mmtp -120.44 139.33 52.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.177 -0.465 . . . . 3.1499999999999999 109.922 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.53 -30.32 71.06 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.409 -0.589 . . . . 2.3500000000000001 109.409 175.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -74.9 -19.35 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 4.1600000000000001 110.698 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -89.96 -13.13 36.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.166 0.508 . . . . 2.5699999999999998 110.0 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 2' ' ' LYS . 70.8 mt -77.52 129.78 76.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 109.079 -0.712 . . . . 0.68999999999999995 109.079 175.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.84 113.66 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.336 2.691 . . . . 0.59999999999999998 112.379 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.36 65.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.711 -0.677 . . . . 0.56999999999999995 111.686 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.87 -35.57 76.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.745 0.783 . . . . 1.3700000000000001 110.263 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -85.56 -29.77 23.88 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 114.585 -1.189 . . . . 0.80000000000000004 111.064 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -68.45 -27.05 65.84 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.196 -0.668 . . . . 1.73 109.196 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.61 -32.27 71.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.312 -1.313 . . . . 1.02 110.615 174.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -80.57 -31.08 36.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.543 -0.753 . . . . 0.93000000000000005 111.194 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 73.7 mtm -71.21 134.83 84.89 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 1.1499999999999999 111.33 -176.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.4 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 44.1 Cg_endo -68.92 146.02 63.99 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.721 2.281 . . . . 0.90000000000000002 112.265 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -43.74 -49.35 8.11 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 123.721 2.947 . . . . 0.95999999999999996 113.813 -173.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.536 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.8 pm0 -57.56 -39.41 76.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.798 0.332 . . . . 1.8300000000000001 111.811 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -14.51 60.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.774 0.321 . . . . 0.81999999999999995 111.072 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 19' ' ' ARG . 16.8 mtm180 -91.39 -33.71 15.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 2.1600000000000001 110.299 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.05 -45.45 32.26 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.579 . . . . 1.0600000000000001 111.45 178.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.446 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 38.5 t80 -70.81 1.19 5.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.833 -0.621 . . . . 0.65000000000000002 112.334 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.535 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.9 mt -127.83 -16.27 4.72 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.569 -0.707 . . . . 1.1299999999999999 111.27 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.51 -41.25 98.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.886 -0.783 . . . . 2.0600000000000001 108.886 164.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -75.58 -51.78 12.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.142 -0.936 . . . . 1.8400000000000001 112.709 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.535 HD13 HD11 ' A' ' 33' ' ' LEU . 42.0 mt -58.14 142.04 48.43 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.951 0.882 . . . . 1.05 112.79 -172.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.0 p -136.35 -164.55 1.58 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 113.957 -1.474 . . . . 1.78 109.804 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.72 151.52 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.703 0.287 . . . . 2.3900000000000001 110.432 177.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . 86.9 -45.56 3.45 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.666 -0.778 . . . . 0.93000000000000005 112.374 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.618 ' O ' HG12 ' A' ' 32' ' ' VAL . 6.4 m-20 -74.67 -37.05 62.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.542 0.687 . . . . 2.25 109.733 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HA ' HD12 ' A' ' 33' ' ' LEU . 89.0 mttt -70.33 -18.02 63.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.633 -0.712 . . . . 1.3100000000000001 110.194 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 53.1 m -66.89 -40.85 87.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.098 -0.955 . . . . 0.80000000000000004 111.003 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.3 p -79.23 -27.06 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 0.84999999999999998 110.631 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 25' ' ' LEU . 87.8 mt -56.92 -49.84 74.39 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 111.8 0.296 . . . . 0.97999999999999998 111.8 177.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.0 pttm -61.09 -25.26 66.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.822 0.344 . . . . 2.4100000000000001 110.884 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.78 -35.97 75.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.02 0.438 . . . . 1.96 110.438 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.2 t -73.81 -55.89 10.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.575 0.702 . . . . 0.97999999999999998 110.137 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HD2' ' O ' ' A' ' 33' ' ' LEU . 72.9 m-85 -58.27 -46.56 85.81 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 114.763 1.394 . . . . 0.82999999999999996 114.763 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -77.98 -13.55 59.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 118.501 0.591 . . . . 2.1800000000000002 111.326 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -79.8 -78.33 0.16 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.325 -0.398 . . . . 1.5600000000000001 109.997 170.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 45.94 -157.56 0.37 Allowed Glycine 0 CA--C 1.523 0.54 0 C-N-CA 121.01 -0.614 . . . . 1.54 113.394 -174.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.4 Cg_endo -91.47 172.69 21.91 Favored 'Cis proline' 0 N--CA 1.457 -0.663 0 C-N-CA 124.231 -1.154 . . . . 1.6799999999999999 111.196 -7.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.49 106.53 8.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.272 0.558 . . . . 1.28 111.671 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -72.71 -18.92 61.49 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.205 -0.907 . . . . 3.5099999999999998 110.026 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -145.5 157.92 43.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 1.52 109.61 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.5 m -76.13 -27.42 57.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.953 -0.567 . . . . 1.1799999999999999 111.518 -174.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -58.57 -42.99 89.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.728 0.299 . . . . 2.2400000000000002 110.842 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.24 -33.81 72.82 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.34 0.59 . . . . 2.2599999999999998 110.896 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.8 t -74.04 -42.55 60.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 1.1899999999999999 110.364 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 78.4 mt -64.32 -42.53 95.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.326 0.584 . . . . 0.55000000000000004 109.886 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.34 -38.05 76.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.137 -0.938 . . . . 0.56999999999999995 111.381 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.65 -38.08 80.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.412 0.625 . . . . 0.5 110.349 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.81 -35.55 67.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.289 -0.869 . . . . 0.45000000000000001 111.17 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -63.37 -41.81 98.82 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 121.071 -0.252 . . . . 1.22 111.656 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.71 -33.57 66.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.929 0.395 . . . . 3.0499999999999998 110.791 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.436 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 29.7 mmtm -77.82 -47.67 18.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.158 -0.474 . . . . 1.48 111.716 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -148.62 95.51 3.98 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-O 120.688 0.28 . . . . 1.1599999999999999 110.67 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -41.07 -56.53 1.67 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 124.122 3.215 . . . . 0.57999999999999996 113.827 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.02 -33.26 75.04 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 115.193 -0.912 . . . . 2.4500000000000002 112.435 -178.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -72.25 -42.36 65.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.8 -0.815 . . . . 1.4199999999999999 108.8 -176.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.421 ' HA2' HG22 ' A' ' 63' ' ' VAL . . . -64.91 -33.99 88.7 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.051 -1.431 . . . . 0.37 111.449 174.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.1 72.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.763 0.316 . . . . 0.47999999999999998 110.895 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 26.7 mtpp -67.03 -54.92 17.05 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.595 -0.275 . . . . 2.1699999999999999 110.337 175.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.421 HG22 ' HA2' ' A' ' 60' ' ' GLY . 25.6 m -67.61 -22.61 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.166 0 C-N-CA 120.906 -0.318 . . . . 1.1200000000000001 111.188 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.75 -58.26 9.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.064 -0.516 . . . . 1.7 109.838 172.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -71.95 -32.58 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.798 -0.637 . . . . 3.96 109.969 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -62.61 -41.6 99.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 1.5 109.452 179.316 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -74.3 -38.76 63.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.913 -0.773 . . . . 2.3399999999999999 108.913 -176.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.33 95.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.821 -1.081 . . . . 0.40000000000000002 111.014 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 28.9 mtp -55.88 -55.01 37.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.097 0.475 . . . . 0.71999999999999997 110.8 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.453 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 69.3 t -58.58 -44.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-N 115.149 -0.932 . . . . 0.79000000000000004 110.554 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -60.54 -37.51 81.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.671 -0.695 . . . . 1.47 111.512 177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.8 m -64.09 -37.78 88.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 1.26 110.859 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 95.8 mttt -72.44 -23.68 61.1 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.435 -0.348 . . . . 1.54 110.576 177.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.45 HG23 ' HB2' ' A' ' 82' ' ' LYS . 67.3 mt -89.15 -19.14 7.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.769 0.795 . . . . 0.34000000000000002 110.159 175.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.03 -36.77 58.95 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.211 -0.904 . . . . 0.34999999999999998 109.789 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.509 ' HB3' ' OE1' ' A' ' 135' ' ' GLN . . . -90.55 -8.01 51.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.722 -1.126 . . . . 0.48999999999999999 109.448 -178.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.8 tp -86.9 121.9 30.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 106.377 -1.712 . . . . 0.70999999999999996 106.377 172.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.803 ' N ' ' HD3' ' A' ' 79' ' ' PRO . . . -99.21 -12.36 42.53 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.528 1.371 . . . . 0.76000000000000001 116.528 -172.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.803 ' HD3' ' N ' ' A' ' 78' ' ' GLY . 8.6 Cg_endo -98.97 -146.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.089 0 CA-C-N 121.501 2.651 . . . . 1.5600000000000001 116.844 -170.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -80.01 -7.07 58.63 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 106.613 -1.625 . . . . 2.52 106.613 167.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -68.88 -36.49 78.14 Favored 'General case' 0 CA--C 1.499 -0.982 0 CA-C-N 115.361 -0.836 . . . . 0.35999999999999999 109.467 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.626 ' HD2' ' O ' ' A' ' 77' ' ' LEU . 1.0 OUTLIER -72.42 -36.75 68.69 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.635 -0.711 . . . . 2.04 109.098 177.031 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.408 ' N ' ' HG2' ' A' ' 82' ' ' LYS . . . -64.36 -43.44 96.83 Favored Glycine 0 C--N 1.336 0.542 0 C-N-CA 120.091 -1.052 . . . . 0.40999999999999998 111.623 174.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 8.8 t80 -66.06 -39.05 89.78 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.708 0.403 . . . . 1.6499999999999999 111.063 176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.55 -43.03 79.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.483 0.658 . . . . 0.40999999999999998 110.356 177.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 7.4 mm-40 -59.46 -30.88 68.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.008 -0.996 . . . . 1.96 111.108 177.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -87.37 -47.01 9.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.435 -0.348 . . . . 2.1200000000000001 111.032 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.428 ' HB3' ' CE1' ' A' ' 84' ' ' PHE . 10.1 p -61.11 -47.08 87.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.198 -0.455 . . . . 0.56999999999999995 111.472 -175.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.0 -40.11 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 1.0900000000000001 110.279 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -62.8 -45.01 94.63 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.372 -0.377 . . . . 2.8199999999999998 111.178 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -65.01 -46.56 91.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.579 -0.282 . . . . 0.51000000000000001 110.932 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.73 88.46 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.299 0.571 . . . . 0.64000000000000001 110.007 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt85 -59.38 -35.84 74.67 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.346 -0.843 . . . . 4.4199999999999999 110.78 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.03 -35.34 90.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.018 -0.61 . . . . 0.66000000000000003 112.474 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.613 HG21 HD23 ' A' ' 110' ' ' LEU . 49.1 mm -71.69 -48.22 53.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.095 0.474 . . . . 0.55000000000000004 109.921 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -85.23 27.53 0.79 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.668 0.747 . . . . 2.7000000000000002 110.258 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -117.06 -27.65 6.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.63 109.599 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.434 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 17.8 ptp180 -91.47 -1.03 57.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.116 -0.493 . . . . 3.1000000000000001 109.997 176.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -83.65 -38.59 21.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.999 -0.741 . . . . 0.96999999999999997 108.999 163.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.535 ' CE1' HD21 ' A' ' 22' ' ' LEU . 4.4 m-30 -67.86 -24.96 65.31 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.349 -0.841 . . . . 1.48 111.41 -173.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -77.65 -4.58 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.853 -0.612 . . . . 0.87 112.177 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.79 7.83 65.97 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.415 -0.897 . . . . 1.1599999999999999 111.346 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -100.55 166.0 11.14 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.865 -0.791 . . . . 1.8300000000000001 108.865 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 50.2 mt-10 -134.92 110.22 10.93 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 121.028 -0.269 . . . . 1.75 111.297 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 14.6 Cg_endo -61.55 151.55 79.24 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.416 2.078 . . . . 0.53000000000000003 111.348 173.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.7 p -81.17 167.57 19.5 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.576 -0.527 . . . . 1.48 109.576 177.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.494 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 39.4 ttpt -64.24 -29.64 70.73 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.249 -0.649 . . . . 2.8799999999999999 109.249 177.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -65.34 -36.28 83.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.241 -0.891 . . . . 2.2400000000000002 110.896 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -60.69 -44.32 96.66 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.121 0.486 . . . . 1.73 109.985 173.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.613 HD23 HG21 ' A' ' 95' ' ' ILE . 61.7 mt -66.32 -40.31 89.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.298 -0.864 . . . . 0.81999999999999995 111.411 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 94.5 mttt -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.091 0.472 . . . . 1.74 110.238 176.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.549 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -62.51 -43.98 97.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.765 -0.652 . . . . 0.46999999999999997 111.541 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.445 ' O ' HG13 ' A' ' 117' ' ' VAL . 5.2 p -61.77 -32.25 72.51 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.38 0.511 . . . . 1.3400000000000001 112.38 -177.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.9 m -87.63 -25.74 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-O 121.511 0.672 . . . . 0.65000000000000002 110.126 -178.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.9 ptmm? -79.61 -24.62 41.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.509 -0.769 . . . . 1.72 110.937 -175.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 20.1 mm-40 -78.76 -38.95 37.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.341 -0.543 . . . . 2.27 110.438 175.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.5 m -66.36 -29.43 46.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.611 -0.435 . . . . 0.81000000000000005 110.017 176.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.91 -40.83 78.89 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.086 -0.709 . . . . 1.21 109.086 172.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 5.4 tmmm? -54.02 -46.56 71.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.731 -0.668 . . . . 0.94999999999999996 110.289 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.32 -46.82 81.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.384 -0.371 . . . . 1.0600000000000001 111.342 171.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 48.3 t80 -72.54 -33.52 66.91 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 119.739 -0.784 . . . . 1.54 112.41 -167.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -63.77 -32.34 73.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 1.98 110.573 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.95 -4.34 59.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.232 0.827 . . . . 0.69999999999999996 113.232 -171.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 37.4 mtm -75.53 155.68 35.85 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.093 -0.643 . . . . 0.5 110.712 -178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.6 m -60.79 146.65 45.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.52 -0.309 . . . . 1.1799999999999999 110.208 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.19 -47.56 75.08 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.25 0.463 . . . . 2.21 112.25 -170.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.94 -33.14 68.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.41999999999999998 110.882 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -72.41 -38.33 58.23 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.477 -0.783 . . . . 0.31 111.651 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.32 -45.95 82.23 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.705 -0.48 . . . . 1.3200000000000001 109.705 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.75 90.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.605 -0.725 . . . . 0.41999999999999998 111.461 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.8 -29.92 70.9 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.018 0.437 . . . . 0.55000000000000004 110.386 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -58.8 -27.97 65.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.718 -0.673 . . . . 0.39000000000000001 110.514 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.421 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -68.56 -23.59 75.31 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.243 -0.503 . . . . 0.27000000000000002 113.145 -178.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.19 21.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.938 0.399 . . . . 2.4300000000000002 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.509 ' OE1' ' HB3' ' A' ' 76' ' ' ALA . 32.9 mm-40 -82.55 -46.39 13.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.713 -0.676 . . . . 1.8300000000000001 112.057 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.453 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 39.0 m-85 -122.08 73.33 36.67 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 121.144 0.497 . . . . 0.68999999999999995 110.107 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' PRO . . . . . 0.414 ' O ' ' HB2' ' A' ' 141' ' ' LYS . 54.9 Cg_endo -68.69 -25.79 33.66 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.994 2.463 . . . . 0.63 112.895 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' HG13 ' A' ' 142' ' ' VAL . 3.6 m-85 -68.72 -50.6 49.44 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.546 -0.297 . . . . 2.3100000000000001 111.166 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.49 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -66.39 -44.35 83.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.676 -0.49 . . . . 1.02 109.676 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.421 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -55.34 -46.54 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.016 0.436 . . . . 0.34999999999999998 110.612 177.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 137' ' ' PRO . 0.8 OUTLIER -47.59 -67.43 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.252 -0.886 . . . . 2.5800000000000001 111.447 174.704 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.7 m -63.93 -23.07 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.014 -0.994 . . . . 0.5 112.798 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.49 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 22.2 m-30 -77.59 -44.54 28.06 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.316 -0.553 . . . . 0.62 110.746 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.07 -35.27 71.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.13 0.49 . . . . 2.5800000000000001 110.13 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.1 m -82.6 167.57 18.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.37 -0.832 . . . . 1.3200000000000001 110.307 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -78.79 55.25 4.2 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.895 -0.669 . . . . 1.0900000000000001 111.502 176.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.502 ' HG2' ' HB ' ' A' ' 142' ' ' VAL . 15.7 tppt? -108.84 -76.3 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.228 -0.286 . . . . 1.98 110.228 -179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.2 80.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.34000000000000002 110.55 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.33 68.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.51000000000000001 111.471 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -85.44 -38.07 19.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.187 -0.46 . . . . 2.8199999999999998 111.111 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -58.34 -39.98 80.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.157 0.503 . . . . 0.48999999999999999 109.783 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.526 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -65.64 -31.52 72.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.444 -0.798 . . . . 0.58999999999999997 111.093 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 64.24 61.04 6.39 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.938 -0.649 . . . . 1.6200000000000001 111.673 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.697 ' HG3' ' ND2' ' A' ' 155' ' ' ASN . 3.1 pt-20 -150.37 7.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.13 0.419 . . . . 4.1200000000000001 112.13 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.697 ' ND2' ' HG3' ' A' ' 154' ' ' GLU . 58.9 m-80 . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.621 -0.704 . . . . 4.0099999999999998 109.702 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.258 -0.275 . . . . 23.59 110.258 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 74.44 -106.76 2.11 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.775 -0.726 . . . . 22.469999999999999 111.501 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.1 t -102.77 85.98 2.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 21.510000000000002 110.175 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 19.7 m -125.67 -15.74 5.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.955 -0.566 . . . . 20.190000000000001 110.935 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -162.89 41.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.287 . . . . 21.420000000000002 111.391 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.98 81.15 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.971 0.415 . . . . 18.199999999999999 110.479 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -160.86 70.54 0.39 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.385 0.612 . . . . 16.059999999999999 110.522 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -66.36 -28.06 68.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.711 -0.677 . . . . 13.27 109.565 176.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -136.98 115.67 12.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.752 . . . . 12.33 109.366 173.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -115.47 -14.52 11.55 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.822 -0.351 . . . . 11.33 111.092 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 18.4 m -85.26 88.36 7.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 7.9500000000000002 109.94 178.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 39.1 t -79.99 118.82 22.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.141 -0.481 . . . . 7.3600000000000003 110.616 -177.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -94.45 14.22 65.75 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.869 -0.682 . . . . 4.5700000000000003 111.62 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -152.82 55.13 0.78 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.055 0.455 . . . . 4.5199999999999996 111.041 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 54.7 tpp -65.52 112.59 3.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.677 -0.49 . . . . 2.0 109.677 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -63.18 148.04 49.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.74 -0.664 . . . . 1.47 111.045 -174.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.402 ' H ' ' HB3' ' A' ' 5' ' ' ASP . 68.6 mttm -113.83 165.68 12.33 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.887 -0.597 . . . . 3.1499999999999999 109.68 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -55.33 -51.11 67.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 2.3500000000000001 110.254 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -77.75 10.32 2.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.868 -0.605 . . . . 4.1600000000000001 112.463 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 2' ' ' LYS . 30.6 t70 -102.04 -19.57 15.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.127 0.489 . . . . 2.5699999999999998 110.633 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.45 ' HB ' ' HD3' ' A' ' 11' ' ' ARG . 50.9 mt -74.02 138.93 76.01 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.012 -0.736 . . . . 0.68999999999999995 109.012 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.49 ' HG2' HD22 ' A' ' 110' ' ' LEU . 25.2 Cg_exo -37.69 110.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.492 2.795 . . . . 0.59999999999999998 112.603 175.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' ASP . . . -70.06 -17.39 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.681 -0.691 . . . . 0.56999999999999995 111.923 -171.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -69.55 -32.3 71.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.923 0.868 . . . . 1.3700000000000001 108.911 176.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.444 ' CG ' HD23 ' A' ' 110' ' ' LEU . 81.1 t80 -82.57 -38.11 24.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.044 -1.435 . . . . 0.80000000000000004 110.816 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.45 ' HD3' ' HB ' ' A' ' 6' ' ' ILE . 50.6 mtm180 -67.18 -27.99 67.73 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.737 0.78 . . . . 1.73 109.622 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 1.0 OUTLIER -69.93 -10.59 59.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.289 -1.323 . . . . 1.02 111.068 176.038 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.9 mt -97.95 -16.4 19.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.355 . . . . 0.93000000000000005 110.311 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.3 mtm -82.24 135.13 47.77 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.316 -0.402 . . . . 1.1499999999999999 111.209 -174.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.435 ' HD3' HD21 ' A' ' 139' ' ' LEU . 72.1 Cg_endo -75.48 160.62 38.38 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.881 2.387 . . . . 0.90000000000000002 112.489 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -43.65 -49.1 8.2 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 123.255 2.637 . . . . 0.95999999999999996 112.913 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.18 -60.03 2.76 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.087 0.47 . . . . 1.8300000000000001 111.412 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 -8.46 54.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.81999999999999995 112.007 -173.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -96.84 -34.66 11.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.502 -0.317 . . . . 2.1600000000000001 110.749 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -52.05 -47.65 64.99 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.361 0.413 . . . . 1.0600000000000001 111.645 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.485 ' O ' HD23 ' A' ' 25' ' ' LEU . 33.7 t80 -60.56 -60.24 4.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.172 -0.467 . . . . 0.65000000000000002 111.571 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.488 HD21 ' CE1' ' A' ' 100' ' ' TYR . 34.6 mt -75.82 -4.65 41.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.274 0.943 . . . . 1.1299999999999999 112.336 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -68.41 -36.19 78.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.498 -0.556 . . . . 2.0600000000000001 109.498 163.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -78.02 -50.08 12.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.267 -0.879 . . . . 1.8400000000000001 112.253 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.4 mm? -55.25 138.04 46.01 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.259 0.552 . . . . 1.05 110.786 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.3 m -121.58 -67.61 0.95 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 1.78 111.278 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -164.07 -52.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.74 0.274 . . . . 2.3900000000000001 111.74 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -70.03 -30.8 69.69 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.829 -0.7 . . . . 0.93000000000000005 111.552 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.708 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.5 p30 -72.53 -41.65 65.6 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.179 -0.511 . . . . 2.25 110.526 175.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.26 -20.68 63.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.13 0.49 . . . . 1.3100000000000001 110.776 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 58.2 m -67.8 -30.07 69.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.631 -0.713 . . . . 0.80000000000000004 110.936 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.708 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -90.81 -30.12 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-N 116.29 -0.414 . . . . 0.84999999999999998 110.773 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.615 ' O ' HG22 ' A' ' 36' ' ' VAL . 4.4 mm? -53.92 -45.85 71.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.351 0.12 . . . . 0.97999999999999998 110.967 173.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 17.8 pttp -59.9 -27.08 66.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.591 -0.444 . . . . 2.4100000000000001 110.959 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -78.18 -39.02 42.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.8 0.333 . . . . 1.96 110.439 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 32' ' ' VAL . 2.3 m -69.83 -37.41 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.97999999999999998 110.219 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 24.9 m-85 -67.49 -38.22 84.03 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.238 1.199 . . . . 0.82999999999999996 114.238 173.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -85.25 16.87 3.33 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.627 -0.829 . . . . 2.1800000000000002 110.291 -178.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.93 11.57 17.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 1.5600000000000001 109.541 174.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.69 -159.97 32.72 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.521 -0.763 . . . . 1.54 111.849 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.55 160.0 93.89 Favored 'Cis proline' 0 C--O 1.233 0.274 0 C-N-CA 123.675 -1.386 . . . . 1.6799999999999999 112.839 1.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.551 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 60.0 m-85 -116.6 140.92 48.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.629 -0.714 . . . . 1.28 110.106 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.3 -12.97 60.16 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.634 -0.712 . . . . 3.5099999999999998 110.289 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -158.06 165.58 34.68 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.116 -0.493 . . . . 1.52 110.286 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -65.89 -30.15 70.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.118 0.485 . . . . 1.1799999999999999 110.588 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -54.08 -42.82 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.435 -0.802 . . . . 2.2400000000000002 112.087 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.551 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 30.3 mt-10 -63.76 -33.14 74.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.418 -0.355 . . . . 2.2599999999999998 111.131 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.5 t -73.21 -32.23 64.66 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.849 -0.426 . . . . 1.1899999999999999 109.849 177.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.7 -40.84 90.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.406 0.622 . . . . 0.55000000000000004 109.556 175.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.81 -46.18 90.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.035 -0.984 . . . . 0.56999999999999995 110.879 175.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.421 ' CB ' ' HB ' ' A' ' 36' ' ' VAL . . . -56.77 -39.14 73.49 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.053 -0.522 . . . . 0.5 110.973 177.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 33' ' ' LEU . 14.1 mt -71.21 -42.25 69.2 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.45000000000000001 111.448 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -61.14 -34.66 75.35 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.874 0.368 . . . . 1.22 111.429 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -73.95 -38.29 64.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.056 -0.52 . . . . 3.0499999999999998 111.657 -179.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -91.48 -36.89 13.49 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.228 0.455 . . . . 1.48 112.228 -175.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -145.18 88.27 6.83 Favored Pre-proline 0 C--N 1.32 -0.715 0 N-CA-C 109.336 -0.616 . . . . 1.1599999999999999 109.336 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 63.1 Cg_exo -41.18 -54.41 2.59 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 124.102 3.201 . . . . 0.57999999999999996 113.751 -170.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 6.1 mp0 -58.96 -36.0 74.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.945 -1.025 . . . . 2.4500000000000002 112.326 -177.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.55 -36.6 79.01 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 120.011 -0.676 . . . . 1.4199999999999999 109.315 -175.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.13 81.52 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.639 -1.164 . . . . 0.37 111.707 176.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 -38.79 63.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.75 0.31 . . . . 0.47999999999999998 110.547 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.4 mmmt -63.2 -42.12 99.28 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.116 -0.493 . . . . 2.1699999999999999 110.602 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.63 -30.07 16.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.392 -0.367 . . . . 1.1200000000000001 110.718 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.46 -51.86 63.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.549 -0.296 . . . . 1.7 110.628 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 69' ' ' MET . 20.9 pttp -60.11 -35.49 75.34 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.774 0.797 . . . . 3.96 109.573 -177.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.474 ' C ' HD13 ' A' ' 66' ' ' LEU . 1.5 tm? -65.04 -48.5 73.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.387 -1.279 . . . . 1.5 110.303 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.581 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 84.2 t60 -77.98 -32.12 51.09 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.52 -0.548 . . . . 2.3399999999999999 109.52 -170.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.37 93.6 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.379 -0.828 . . . . 0.40000000000000002 111.528 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 60.7 mtm -56.32 -52.15 65.59 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.649 0.738 . . . . 0.71999999999999997 109.367 174.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 66' ' ' LEU . 52.9 t -51.66 -49.47 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 114.107 -1.406 . . . . 0.79000000000000004 110.917 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.1 mmmt -63.2 -40.63 98.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.749 . . . . 1.47 111.928 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.9 t -60.56 -40.05 90.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.022 0.439 . . . . 1.26 110.666 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 95.2 mttt -74.0 -41.71 61.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.836 -0.62 . . . . 1.54 110.788 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -69.93 -26.24 29.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.196 0.522 . . . . 0.34000000000000002 110.807 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.6 81.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.579 0.704 . . . . 0.34999999999999998 109.924 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.07 -2.29 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.743 -1.117 . . . . 0.48999999999999999 110.743 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.471 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 11.7 tp -95.05 133.28 39.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.823 -0.626 . . . . 0.70999999999999996 109.731 -176.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.41 151.2 50.54 Favored Glycine 0 C--O 1.226 -0.394 0 C-N-CA 120.8 -0.714 . . . . 0.76000000000000001 112.0 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -39.17 -40.4 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.391 3.394 . . . . 1.5600000000000001 114.495 -176.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -70.02 -46.24 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.263 -0.175 . . . . 2.52 111.236 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.471 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -80.29 -33.17 37.91 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.606 0.717 . . . . 0.35999999999999999 109.974 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -58.03 -44.4 87.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.676 -1.147 . . . . 2.04 111.304 177.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.23 -38.83 96.29 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 0.40999999999999998 111.927 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 15.4 t80 -68.47 -44.05 75.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.526 0.203 . . . . 1.6499999999999999 110.998 176.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.22 85.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.034 0.445 . . . . 0.40999999999999998 111.024 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -62.46 -39.71 94.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.83 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -71.06 -51.28 26.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 2.1200000000000001 111.529 -177.263 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.3 p -59.15 -39.91 83.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.952 0.406 . . . . 0.56999999999999995 110.997 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.7 mt -70.34 -41.03 78.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 116.091 -0.504 . . . . 1.0900000000000001 111.603 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 14.8 pt-20 -69.68 -28.01 65.49 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.454 -0.498 . . . . 2.8199999999999998 110.668 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 87' ' ' LYS . 98.2 mt -69.77 -48.96 61.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.014 0.435 . . . . 0.51000000000000001 110.044 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.49 -33.93 76.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.92 -0.582 . . . . 0.64000000000000001 110.734 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -56.96 -39.78 75.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.955 -0.566 . . . . 4.4199999999999999 110.38 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 98' ' ' ARG . . . -66.98 -30.72 76.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.927 -0.654 . . . . 0.66000000000000003 112.015 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -63.53 -53.8 40.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.075 0.464 . . . . 0.55000000000000004 110.542 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -74.48 -15.67 60.88 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.361 -0.382 . . . . 2.7000000000000002 110.863 177.672 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.03 71.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 119.936 -0.706 . . . . 0.63 109.989 170.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.456 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 47.1 mtt180 -88.77 -9.43 51.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.184 -0.462 . . . . 3.1000000000000001 110.186 176.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.442 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 30.6 m-85 -83.25 -43.94 15.51 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.392 -0.596 . . . . 0.96999999999999997 109.392 167.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.521 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 25.8 m-85 -61.08 -36.3 79.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.192 -0.458 . . . . 1.48 111.778 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 1.8 p -74.49 -11.44 60.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.87 112.737 -176.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.14 58.76 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.839 -0.696 . . . . 1.1599999999999999 113.225 -176.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -88.71 -42.89 11.68 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.907 0.354 . . . . 1.8300000000000001 111.236 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 65.41 88.88 0.11 Allowed Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 123.728 0.642 . . . . 1.75 112.321 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.94 144.43 5.96 Favored 'Trans proline' 0 C--O 1.237 0.457 0 C-N-CA 123.62 2.88 . . . . 0.53000000000000003 113.019 172.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.7 t -79.61 166.0 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.047 -0.723 . . . . 1.48 109.047 174.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 22.0 ptmt -58.03 -34.44 70.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.283 0.492 . . . . 2.8799999999999999 110.496 -176.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.99 -25.55 66.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.746 -0.661 . . . . 2.2400000000000002 111.493 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -70.16 -40.59 74.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.347 0.594 . . . . 1.73 109.982 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.9 mp -72.41 -39.68 67.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.81999999999999995 110.716 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.0 mtpm? -58.32 -47.02 85.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.229 0.538 . . . . 1.74 110.021 176.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -64.53 -39.25 93.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.532 -0.758 . . . . 0.46999999999999997 112.301 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.9 p -71.88 -31.9 66.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.396 0.517 . . . . 1.3400000000000001 112.396 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.868 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.9 m -78.41 -24.43 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.458 0.647 . . . . 0.65000000000000002 109.307 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 63.5 mttm -53.26 -48.78 67.99 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.276 -0.874 . . . . 1.72 111.385 174.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' LEU . 6.4 mm-40 -70.27 -33.42 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.391 -0.368 . . . . 2.27 110.922 -171.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.3 m -67.95 -28.03 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 C-N-CA 120.231 -0.588 . . . . 0.81000000000000005 109.95 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.528 HD13 ' HA ' ' A' ' 149' ' ' ALA . 44.3 mt -82.35 -30.31 30.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.81 0.338 . . . . 1.21 110.283 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -61.49 -35.42 77.61 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.607 0.718 . . . . 0.94999999999999996 109.264 177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 124' ' ' MET . 10.8 mp -81.87 -45.7 15.13 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 114.755 -1.111 . . . . 1.0600000000000001 111.369 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 143' ' ' PHE . 47.4 t80 -74.63 -36.32 62.91 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 119.301 -0.96 . . . . 1.54 111.611 -169.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -66.66 -29.49 69.51 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.221 -0.659 . . . . 1.98 109.221 176.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -102.22 72.1 1.28 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.189 -0.914 . . . . 0.69999999999999996 110.809 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.618 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 32.0 mtm -150.02 157.47 43.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.691 -0.686 . . . . 0.5 110.669 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.4 m -62.57 138.35 58.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.228 0.537 . . . . 1.1799999999999999 110.445 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -58.49 -37.88 76.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.128 -0.942 . . . . 2.21 112.533 -172.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.92 -34.83 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 0.41999999999999998 110.834 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.69 -38.69 56.86 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.985 -0.626 . . . . 0.31 111.64 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.79 -45.22 90.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.042 0.448 . . . . 1.3200000000000001 110.608 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.0 71.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.77 -0.65 . . . . 0.41999999999999998 111.782 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -74.23 -30.72 62.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.55000000000000004 109.823 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -60.32 -31.08 69.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.912 -0.586 . . . . 0.39000000000000001 109.928 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.75 -12.03 73.95 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 121.092 -0.575 . . . . 0.27000000000000002 112.849 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -86.51 -33.29 20.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.58 0.705 . . . . 2.4300000000000002 109.781 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.6 mm-40 -92.25 -38.8 11.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.001 -1.0 . . . . 1.8300000000000001 110.934 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -131.26 75.14 78.19 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-O 121.215 0.531 . . . . 0.68999999999999995 110.166 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -66.86 -29.38 41.77 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.433 2.756 . . . . 0.63 113.043 -175.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.583 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 26.0 t80 -74.45 -37.04 63.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.949 0.404 . . . . 2.3100000000000001 109.933 -177.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.435 HD21 ' HD3' ' A' ' 15' ' ' PRO . 79.0 mt -74.9 -46.64 34.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 1.02 110.302 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.95 -39.16 74.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.34999999999999998 109.907 177.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 55.2 tttp -44.4 -68.31 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.131 -0.94 . . . . 2.5800000000000001 111.701 172.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG12 ' HD3' ' A' ' 147' ' ' LYS . 2.2 m -71.9 -16.24 18.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 114.997 -1.001 . . . . 0.5 112.753 -173.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HB3' ' CD2' ' A' ' 121' ' ' TYR . 22.3 m-30 -84.95 -36.41 21.41 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.433 -0.507 . . . . 0.62 110.941 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 48.0 mt-10 -66.42 -52.35 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.081 0.467 . . . . 2.5800000000000001 109.881 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -75.16 159.45 31.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.682 -0.69 . . . . 1.3200000000000001 109.929 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.07 52.41 3.32 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.738 -0.744 . . . . 1.0900000000000001 111.828 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.443 ' HD3' HG12 ' A' ' 142' ' ' VAL . 61.6 tttm -100.06 -64.25 1.06 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.789 0.328 . . . . 1.98 110.155 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.45 -33.76 69.64 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.301 0.572 . . . . 0.34000000000000002 109.544 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.528 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -55.79 -37.91 69.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.098 -0.956 . . . . 0.51000000000000001 111.55 177.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -85.81 -20.21 29.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.541 -0.3 . . . . 2.8199999999999998 111.413 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.437 ' HD2' HG21 ' A' ' 114' ' ' VAL . 68.0 t80 -74.34 -34.07 63.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.532 0.682 . . . . 0.48999999999999999 109.316 172.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.868 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.92 -42.53 23.89 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.189 -0.914 . . . . 0.58999999999999997 111.565 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 100.3 1.44 55.72 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.616 -0.994 . . . . 1.6200000000000001 110.616 -170.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.459 ' HG2' ' HB1' ' A' ' 152' ' ' ALA . 24.7 mm-40 -88.29 128.25 35.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.054 -0.573 . . . . 4.1200000000000001 110.137 -177.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 119.045 -0.502 . . . . 4.0099999999999998 109.834 174.704 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.519 0.2 . . . . 23.59 110.481 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.55 81.24 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 22.469999999999999 111.867 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 15.7 m -126.75 136.38 52.34 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.351 -0.611 . . . . 21.510000000000002 109.351 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 16.1 t -75.67 87.11 2.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.137 0.494 . . . . 20.190000000000001 110.317 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -75.81 156.8 34.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.82 -0.627 . . . . 21.420000000000002 110.744 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -86.61 132.26 33.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.038 -0.528 . . . . 18.199999999999999 109.685 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 12.6 p80 -69.47 103.16 1.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.698 0.761 . . . . 16.059999999999999 110.976 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -70.11 134.64 48.39 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.316 -0.856 . . . . 13.27 110.411 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -84.06 130.76 34.85 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.277 -0.42 . . . . 12.33 110.489 -178.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -114.0 -63.86 1.39 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.007 -0.542 . . . . 11.33 109.788 178.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.1 91.64 8.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.091 0.472 . . . . 7.9500000000000002 110.029 174.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.6 m -103.44 140.59 37.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.936 -0.575 . . . . 7.3600000000000003 110.673 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 158.23 -96.24 0.15 Allowed Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.991 -0.623 . . . . 4.5700000000000003 111.55 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -113.75 85.39 2.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.028 0.442 . . . . 4.5199999999999996 110.511 178.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 7.5 tpt -144.88 129.61 18.18 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.674 -0.694 . . . . 2.0 109.513 -178.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.762 ' CD1' ' HG2' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -44.48 94.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 O-C-N 124.185 0.928 . . . . 1.47 111.325 177.79 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 tmtp? -100.94 50.5 0.87 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.692 -1.14 . . . . 3.1499999999999999 109.435 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.456 ' CD1' HD12 ' A' ' 6' ' ' ILE . 0.9 OUTLIER 62.06 23.44 13.82 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 107.289 -1.374 . . . . 2.3500000000000001 107.289 -166.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.762 ' HG2' ' CD1' ' A' ' 1' ' ' PHE . 16.0 mm-40 46.64 17.79 0.06 Allowed 'General case' 0 C--N 1.344 0.335 0 N-CA-C 116.441 2.015 . . . . 4.1600000000000001 116.441 171.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.9 t70 48.97 29.98 2.59 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.47 0.652 . . . . 2.5699999999999998 109.9 -172.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.456 HD12 ' CD1' ' A' ' 3' ' ' TYR . 83.2 mt -52.71 132.75 46.78 Favored Pre-proline 0 CA--C 1.519 -0.229 0 CA-C-N 115.673 -0.694 . . . . 0.68999999999999995 110.376 -174.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -35.22 109.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 123.982 3.121 . . . . 0.59999999999999998 112.899 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.29 -17.02 51.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.59 -0.732 . . . . 0.56999999999999995 111.597 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -67.7 -35.46 78.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.703 . . . . 1.3700000000000001 109.275 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.493 ' HA ' HD13 ' A' ' 13' ' ' LEU . 41.4 t80 -89.1 -24.45 22.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.383 -1.28 . . . . 0.80000000000000004 111.098 -176.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -71.21 -22.93 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.041 -0.725 . . . . 1.73 109.041 177.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -24.52 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.774 -1.103 . . . . 1.02 110.541 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 10' ' ' TYR . 9.9 mp -80.37 -43.89 20.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.481 -0.781 . . . . 0.93000000000000005 110.669 178.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.406 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 69.8 mtm -68.36 131.54 91.77 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 1.1499999999999999 110.844 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.556 ' HD3' HD21 ' A' ' 139' ' ' LEU . 26.9 Cg_endo -63.24 152.44 79.78 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.90000000000000002 111.989 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 57.6 Cg_exo -53.08 -27.46 36.65 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.621 2.88 . . . . 0.95999999999999996 112.847 -178.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.56 ' O ' HD21 ' A' ' 66' ' ' LEU . 31.0 mt-10 -64.59 -50.17 68.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.898 -0.592 . . . . 1.8300000000000001 110.641 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.65 70.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.998 0.428 . . . . 0.81999999999999995 110.978 -178.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.406 ' HD2' ' O ' ' A' ' 14' ' ' MET . 41.0 mtp180 -75.64 -32.77 60.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.606 -0.725 . . . . 2.1600000000000001 110.505 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -52.5 -45.9 66.41 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.866 -0.606 . . . . 1.0600000000000001 111.318 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.528 ' O ' HD23 ' A' ' 25' ' ' LEU . 44.1 t80 -57.72 -63.21 1.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.952 -0.567 . . . . 0.65000000000000002 111.657 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.523 HD21 ' CE1' ' A' ' 100' ' ' TYR . 48.9 mt -73.45 -9.91 59.18 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 119.539 1.063 . . . . 1.1299999999999999 112.484 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.94 -36.89 80.9 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.013 0.435 . . . . 2.0600000000000001 110.059 164.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -80.47 -48.76 12.34 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.958 -0.564 . . . . 1.8400000000000001 111.142 -178.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.574 ' HB3' ' CE ' ' A' ' 30' ' ' LYS . 4.4 mm? -57.61 131.52 50.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.439 0.637 . . . . 1.05 111.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.6 m -130.79 -90.39 0.45 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.341 -0.845 . . . . 1.78 111.351 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -125.08 -62.13 1.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.086 0.402 . . . . 2.3900000000000001 112.086 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -61.75 -45.63 95.86 Favored Glycine 0 N--CA 1.453 -0.168 0 C-N-CA 121.101 -0.571 . . . . 0.93000000000000005 113.109 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.601 ' O ' HG12 ' A' ' 32' ' ' VAL . 11.7 m-20 -72.49 -32.61 66.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.22 0.533 . . . . 2.25 110.276 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.574 ' CE ' ' HB3' ' A' ' 25' ' ' LEU . 1.1 tppp? -55.54 -34.84 65.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 1.3100000000000001 111.049 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.6 m -51.99 -41.87 62.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.128 -0.942 . . . . 0.80000000000000004 112.292 176.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.601 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -86.68 -24.2 6.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.464 -0.335 . . . . 0.84999999999999998 111.49 -171.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.548 HD12 ' HE1' ' A' ' 37' ' ' PHE . 4.3 mm? -49.92 -53.08 28.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.789 0.328 . . . . 0.97999999999999998 111.873 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -64.06 -21.08 66.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 2.4100000000000001 111.373 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -76.66 -22.08 54.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.19 -0.459 . . . . 1.96 110.829 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.592 HG12 ' OH ' ' A' ' 42' ' ' TYR . 87.6 t -91.84 -52.3 10.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.578 0.704 . . . . 0.97999999999999998 110.189 177.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.548 ' HE1' HD12 ' A' ' 33' ' ' LEU . 64.8 m-85 -58.24 -39.58 79.5 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.941 1.089 . . . . 0.82999999999999996 113.941 177.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -85.07 16.89 3.2 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.847 -0.741 . . . . 2.1800000000000002 110.862 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.78 21.0 11.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.557 -0.747 . . . . 1.5600000000000001 109.945 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.77 -153.91 9.95 Favored Glycine 0 N--CA 1.452 -0.242 0 N-CA-C 111.32 -0.712 . . . . 1.54 111.32 174.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -83.52 150.64 65.58 Favored 'Cis proline' 0 C--N 1.344 0.318 0 CA-C-N 119.331 1.565 . . . . 1.6799999999999999 112.761 -2.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.592 ' OH ' HG12 ' A' ' 36' ' ' VAL . 13.7 m-85 -86.5 134.14 33.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.915 -0.584 . . . . 1.28 110.011 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -89.27 -17.36 29.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.315 -0.857 . . . . 3.5099999999999998 109.219 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.46 HD21 ' HG3' ' A' ' 47' ' ' GLU . 4.8 p30 -145.99 163.37 35.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.28 -0.873 . . . . 1.52 110.011 -177.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.0 m -65.55 -41.81 92.58 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 1.1799999999999999 111.436 -177.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -55.7 -34.92 65.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 2.2400000000000002 112.534 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.46 ' HG3' HD21 ' A' ' 44' ' ' ASN . 31.6 mt-10 -56.76 -39.49 74.13 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.034 0.383 . . . . 2.2599999999999998 112.034 -177.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.2 t -69.04 -43.87 73.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.958 0.409 . . . . 1.1899999999999999 109.931 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.1 mt -64.52 -44.11 96.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.692 -0.686 . . . . 0.55000000000000004 110.375 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.29 79.5 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.141 -0.936 . . . . 0.56999999999999995 112.069 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.424 ' CB ' HG13 ' A' ' 36' ' ' VAL . . . -64.99 -34.76 79.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.937 0.399 . . . . 0.5 110.81 -177.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 16.9 mt -69.49 -32.2 70.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.912 -0.586 . . . . 0.45000000000000001 111.318 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -67.44 -40.73 85.44 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.836 -0.346 . . . . 1.22 111.188 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -66.4 -28.51 68.68 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.223 0.535 . . . . 3.0499999999999998 110.869 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.537 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 40.3 mmtt -85.69 -44.12 12.83 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.892 -0.595 . . . . 1.48 112.043 176.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -151.5 103.93 2.91 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 120.712 -0.395 . . . . 1.1599999999999999 111.361 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -41.31 -62.69 0.37 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 123.87 3.047 . . . . 0.57999999999999996 113.485 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.36 -29.24 69.94 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.801 -1.09 . . . . 2.4500000000000002 111.387 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tt -73.22 -42.18 62.91 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.407 -0.96 . . . . 1.4199999999999999 108.407 -176.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.414 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -65.45 -25.6 71.44 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 114.353 -1.294 . . . . 0.37 111.467 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.78 -32.03 63.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.938 0.399 . . . . 0.47999999999999998 110.444 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -67.7 -37.99 83.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.282 -0.417 . . . . 2.1699999999999999 111.178 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.0 p -80.13 -29.56 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.176 0.512 . . . . 1.1200000000000001 110.061 175.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.15 -48.91 79.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.86 -0.609 . . . . 1.7 110.782 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.17 -30.57 71.16 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 121.397 0.617 . . . . 3.96 109.432 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -73.33 -3.85 29.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.075 -0.966 . . . . 1.5 111.872 -178.17 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -122.13 -29.68 4.17 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.126 -0.63 . . . . 2.3399999999999999 110.487 171.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.37 -47.34 64.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.659 0.244 . . . . 0.40000000000000002 111.659 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 35.7 mtm -62.63 -39.33 93.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.747 0.784 . . . . 0.71999999999999997 109.484 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.437 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 97.0 t -69.55 -35.49 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 114.709 -1.132 . . . . 0.79000000000000004 110.583 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.12 -39.65 90.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.947 -0.57 . . . . 1.47 110.568 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -55.44 -36.5 66.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.413 0.625 . . . . 1.26 110.371 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 43.7 mttp -77.69 -54.25 6.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.996 -1.002 . . . . 1.54 110.118 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.41 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.6 mt -61.76 -23.2 30.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.34000000000000002 111.361 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.82 65.5 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.66 -0.7 . . . . 0.34999999999999998 109.856 177.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.85 -2.98 52.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.813 -1.085 . . . . 0.48999999999999999 110.016 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.447 HD13 ' HB2' ' A' ' 135' ' ' GLN . 6.8 tp -91.23 135.46 33.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.001 -0.999 . . . . 0.70999999999999996 109.58 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.68 159.75 48.24 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.803 -0.713 . . . . 0.76000000000000001 111.829 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -47.73 -38.22 29.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.304 2.669 . . . . 1.5600000000000001 113.227 -177.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -63.53 -47.73 80.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.343 -0.39 . . . . 2.52 111.228 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -87.05 -29.79 21.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.104 -0.498 . . . . 0.35999999999999999 111.419 -174.406 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.41 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.0 ttpt -57.87 -41.74 83.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.09 -0.505 . . . . 2.04 111.319 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.09 -41.26 96.45 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.564 -0.826 . . . . 0.40999999999999998 112.083 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -71.57 -41.56 68.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.801 -0.2 . . . . 1.6499999999999999 111.057 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -57.81 -49.57 76.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.871 0.367 . . . . 0.40999999999999998 111.666 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.93 -29.3 69.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.353 -0.385 . . . . 1.96 111.522 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.4 OUTLIER -88.42 -38.29 15.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 111.743 0.275 . . . . 2.1200000000000001 111.743 -176.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.5 p -60.3 -39.8 88.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.101 0.477 . . . . 0.56999999999999995 109.769 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -63.82 -41.32 92.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.681 -0.69 . . . . 1.0900000000000001 110.879 175.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 8.0 pt-20 -67.16 -32.72 74.01 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.837 -0.345 . . . . 2.8199999999999998 110.736 -177.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 87' ' ' LYS . 74.3 mt -73.23 -52.31 22.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.82 0.343 . . . . 0.51000000000000001 110.546 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.8 -43.34 98.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.076 -0.511 . . . . 0.64000000000000001 111.206 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 12.3 ptt180 -66.3 -23.38 66.37 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.132 -0.485 . . . . 4.4199999999999999 110.454 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.0 -41.33 55.0 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.005 -0.617 . . . . 0.66000000000000003 112.137 -179.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.0 mm -65.61 -44.39 93.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.818 0.818 . . . . 0.55000000000000004 109.125 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.4 ' HD2' HD12 ' A' ' 22' ' ' LEU . 14.8 ttpp -88.45 29.03 1.02 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.673 -1.148 . . . . 2.7000000000000002 109.887 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 93' ' ' ARG . . . -121.75 -34.48 3.39 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.113 -0.949 . . . . 0.63 110.567 168.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.626 ' O ' ' HB3' ' A' ' 103' ' ' ASN . 17.1 ptm180 -80.88 0.07 36.81 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 120.194 -0.602 . . . . 3.1000000000000001 109.498 176.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.475 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 5.6 m-85 -81.27 -28.78 34.56 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.024 -0.361 . . . . 0.96999999999999997 110.024 165.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.523 ' CE1' HD21 ' A' ' 22' ' ' LEU . 30.9 m-85 -72.44 -34.18 67.59 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.963 0.411 . . . . 1.48 111.272 -178.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.4 p -73.53 -12.08 60.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.659 -0.701 . . . . 0.87 112.554 -173.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.78 55.08 Favored Glycine 0 N--CA 1.453 -0.232 0 N-CA-C 111.103 -0.799 . . . . 1.1599999999999999 111.103 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 98' ' ' ARG . 40.6 t-20 -87.89 162.3 17.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.038 -1.097 . . . . 1.8300000000000001 108.038 176.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.401 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 20.6 mt-10 -139.46 97.92 8.26 Favored Pre-proline 0 C--N 1.32 -0.705 0 O-C-N 122.114 -0.366 . . . . 1.75 110.84 -178.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.7 Cg_endo -57.05 139.89 91.17 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.443 2.095 . . . . 0.53000000000000003 111.634 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.3 t -78.55 165.98 23.1 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.49 -0.559 . . . . 1.48 109.49 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.1 pttp -58.0 -33.78 69.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.279 0.561 . . . . 2.8799999999999999 110.373 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.97 -25.92 65.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.438 -0.801 . . . . 2.2400000000000002 111.015 -179.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -67.81 -45.24 75.3 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.364 -0.606 . . . . 1.73 109.364 176.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.1 mp -63.77 -44.99 91.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.372 -0.831 . . . . 0.81999999999999995 110.4 177.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 30.1 mtpp -56.29 -42.41 77.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 1.74 110.432 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.26 77.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.572 -0.74 . . . . 0.46999999999999997 111.596 177.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.1 p -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.169 0.433 . . . . 1.3400000000000001 112.169 -177.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.916 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.4 m -77.73 -23.67 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.828 0.823 . . . . 0.65000000000000002 109.598 -177.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -67.19 -39.46 86.39 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.093 -0.958 . . . . 1.72 111.26 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 14.1 mm-40 -71.45 -34.32 70.13 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.463 -0.495 . . . . 2.27 110.772 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -65.78 -33.55 64.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.377 -0.529 . . . . 0.81000000000000005 109.932 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' A' ' 149' ' ' ALA . 62.8 mt -72.18 -33.94 68.06 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.76 -0.459 . . . . 1.21 109.76 174.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.1 ttpt -56.93 -44.24 82.3 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.891 -0.781 . . . . 0.94999999999999996 108.891 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.4 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.6 mp -70.91 -48.52 53.18 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.872 -1.058 . . . . 1.0600000000000001 111.467 174.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 129' ' ' LYS . 51.0 t80 -71.24 -30.87 66.86 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 119.498 -0.881 . . . . 1.54 111.526 -167.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -66.84 -35.05 79.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.032 0.444 . . . . 1.98 110.793 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -88.58 -10.21 49.54 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.88 0.696 . . . . 0.69999999999999996 112.88 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.5 mtm -71.15 156.36 39.67 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.837 -0.345 . . . . 0.5 111.692 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.434 ' O ' ' HG2' ' A' ' 129' ' ' LYS . 46.8 t -53.2 141.15 24.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.001 -0.545 . . . . 1.1799999999999999 110.155 173.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.37 -48.9 77.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.816 0.341 . . . . 2.21 110.924 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.66 75.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.541 . . . . 0.41999999999999998 110.815 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -73.13 -44.59 35.0 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.751 -0.659 . . . . 0.31 112.607 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 121' ' ' TYR . 14.1 ptmm? -71.15 -29.08 64.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.989 0.423 . . . . 1.3200000000000001 110.918 -177.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.37 65.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.41999999999999998 110.985 174.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.33 -27.91 67.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.296 0.57 . . . . 0.55000000000000004 109.702 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.49 -25.21 67.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.224 -0.898 . . . . 0.39000000000000001 110.529 174.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.501 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -75.07 -12.48 83.39 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.891 -0.671 . . . . 0.27000000000000002 113.344 -177.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -90.52 -48.23 7.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.434 0.635 . . . . 2.4300000000000002 110.01 -178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.447 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -79.8 -31.97 40.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.115 -0.948 . . . . 1.8300000000000001 110.732 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.437 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 5.9 m-85 -124.75 74.64 64.36 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.786 0.327 . . . . 0.68999999999999995 110.755 175.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.14 -33.97 23.49 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.954 2.436 . . . . 0.63 112.948 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 37.3 t80 -73.93 -42.38 60.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.724 0.297 . . . . 2.3100000000000001 110.718 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.556 HD21 ' HD3' ' A' ' 15' ' ' PRO . 58.2 mt -70.92 -44.27 66.53 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.942 -0.303 . . . . 1.02 110.624 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.501 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -59.36 -39.42 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.34999999999999998 110.148 178.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.2 tttm -46.12 -65.75 0.5 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.315 -0.857 . . . . 2.5800000000000001 111.456 172.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.19 -18.59 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.391 -0.822 . . . . 0.5 112.883 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 18.6 m-85 -81.75 -41.99 20.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.103 -0.639 . . . . 0.62 110.933 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -70.32 -39.17 74.92 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.115 0.483 . . . . 2.5800000000000001 110.6 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.0 t -83.95 161.66 20.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.615 -0.721 . . . . 1.3200000000000001 109.306 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.67 57.74 3.82 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.626 -0.797 . . . . 1.0900000000000001 112.678 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -106.55 -69.18 0.84 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.798 -0.445 . . . . 1.98 109.798 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.04 -40.69 87.23 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.057 0.456 . . . . 0.34000000000000002 109.783 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -56.99 -43.52 81.78 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.521 -0.763 . . . . 0.51000000000000001 110.652 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.02 -38.56 86.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.052 0.453 . . . . 2.8199999999999998 110.413 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -67.52 -34.37 76.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.615 -0.72 . . . . 0.48999999999999999 111.305 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.916 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -89.37 -37.26 14.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.933 0.716 . . . . 0.58999999999999997 112.933 -174.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 155' ' ' ASN . . . 112.51 19.75 6.88 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.814 -0.914 . . . . 1.6200000000000001 110.814 -169.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 155' ' ' ASN . 26.1 tt0 75.32 -32.3 0.22 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.646 1.179 . . . . 4.1200000000000001 112.991 177.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 153' ' ' GLY . 8.8 t30 . . . . . 0 C--O 1.247 0.95 0 O-C-N 124.497 1.123 . . . . 4.0099999999999998 110.294 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 34.2 mtt . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.744 0.306 . . . . 23.59 110.791 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 119.93 90.19 1.21 Allowed Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.269 -0.732 . . . . 22.469999999999999 111.269 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 38.3 t -61.63 124.02 19.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.974 0.416 . . . . 21.510000000000002 110.651 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 27.9 m -96.5 30.98 2.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.074 -0.512 . . . . 20.190000000000001 110.338 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 42.1 m80 61.47 44.32 9.44 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.515 -0.766 . . . . 21.420000000000002 110.811 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -126.53 127.55 45.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.348 -0.842 . . . . 18.199999999999999 109.309 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -81.75 98.96 8.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.931 0.396 . . . . 16.059999999999999 110.405 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 33.5 t60 -128.9 87.01 2.51 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.99 -0.55 . . . . 13.27 109.874 -178.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -87.78 62.09 6.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.167 -0.469 . . . . 12.33 111.516 -175.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 64.3 m80 67.04 -81.4 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.393 -0.821 . . . . 11.33 111.43 178.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.5 m 61.32 49.81 5.15 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.182 0.515 . . . . 7.9500000000000002 111.494 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 46.5 t -134.8 -50.28 0.77 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.139 -0.482 . . . . 7.3600000000000003 110.765 178.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 88.28 -14.31 59.64 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.85 -0.691 . . . . 4.5700000000000003 112.419 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -141.24 25.71 2.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.98 0.419 . . . . 4.5199999999999996 110.751 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 25.0 ttm -127.27 121.05 30.09 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.128 0.489 . . . . 2.0 110.819 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -77.16 161.31 28.31 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.405 -0.816 . . . . 1.47 110.483 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HB3' ' OD1' ' A' ' 5' ' ' ASP . 75.3 tttt -135.62 158.1 45.23 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.043 -0.725 . . . . 3.1499999999999999 109.043 170.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -49.27 -51.52 33.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.167 0.508 . . . . 2.3500000000000001 110.288 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.32 -20.34 66.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.245 -0.889 . . . . 4.1600000000000001 112.405 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.537 ' OD1' ' HB3' ' A' ' 2' ' ' LYS . 2.6 m-20 -88.58 -18.8 27.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.865 0.364 . . . . 2.5699999999999998 110.971 -175.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.2 mt -72.86 131.25 84.19 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.795 -0.817 . . . . 0.68999999999999995 108.795 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -41.33 113.28 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.217 2.611 . . . . 0.59999999999999998 112.163 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -19.65 65.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.798 . . . . 0.56999999999999995 112.218 -171.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.44 -33.47 76.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.773 0.797 . . . . 1.3700000000000001 109.372 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.81 -37.29 22.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.201 -1.363 . . . . 0.80000000000000004 111.502 -175.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -66.13 -31.87 72.99 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.798 -0.815 . . . . 1.73 108.798 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -15.29 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.042 -1.435 . . . . 1.02 111.908 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.4 mt -92.28 -33.95 14.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.721 0.296 . . . . 0.93000000000000005 110.688 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.518 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 70.3 mtm -70.19 142.56 90.09 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 1.1499999999999999 111.191 -176.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.65 149.13 60.75 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.65 2.234 . . . . 0.90000000000000002 111.906 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -44.37 -49.39 8.98 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.866 3.044 . . . . 0.95999999999999996 113.599 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' HD21 ' A' ' 66' ' ' LEU . 46.5 mt-10 -59.05 -43.25 91.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.688 0.28 . . . . 1.8300000000000001 111.703 -176.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.83 -7.12 49.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.81999999999999995 111.227 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.518 ' HD2' ' O ' ' A' ' 14' ' ' MET . 62.2 mtp180 -101.01 -32.54 10.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.85 -0.614 . . . . 2.1600000000000001 110.189 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.81 -46.31 50.91 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.854 -0.612 . . . . 1.0600000000000001 111.392 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 25' ' ' LEU . 58.0 t80 -56.24 -56.59 19.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.965 -0.561 . . . . 0.65000000000000002 111.526 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -78.66 -7.52 57.75 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.609 1.095 . . . . 1.1299999999999999 111.984 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -70.97 -32.86 69.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.93 0.395 . . . . 2.0600000000000001 110.152 164.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -82.67 -49.6 9.62 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.737 -0.665 . . . . 1.8400000000000001 112.244 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 21' ' ' PHE . 2.9 mm? -52.26 134.15 33.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.382 0.61 . . . . 1.05 111.005 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.1 t -130.01 -69.55 0.67 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.444 -0.798 . . . . 1.78 111.289 -174.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -141.24 -78.07 0.28 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.193 0.442 . . . . 2.3900000000000001 112.193 -172.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.405 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -62.75 -30.84 78.19 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.93000000000000005 112.594 -174.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -66.9 -51.69 52.3 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.636 -0.282 . . . . 2.25 110.898 176.694 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 87.7 mttt -56.87 -27.31 60.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.116 0.484 . . . . 1.3100000000000001 110.886 176.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 45.3 m -65.2 -26.92 68.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.774 . . . . 0.80000000000000004 110.717 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.9 p -98.27 -23.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 120.64 -0.424 . . . . 0.84999999999999998 110.808 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.402 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -54.07 -50.36 66.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.74 -0.209 . . . . 0.97999999999999998 111.14 171.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 0.0 OUTLIER -64.97 -25.48 67.89 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.726 0.298 . . . . 2.4100000000000001 111.712 -177.204 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 9.0 mm-40 -68.97 -39.12 79.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.348 -0.387 . . . . 1.96 110.281 175.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.75 -50.66 42.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.936 -0.574 . . . . 0.97999999999999998 110.379 178.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.406 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 20.4 m-85 -54.6 -46.45 73.8 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 114.066 1.135 . . . . 0.82999999999999996 114.066 177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -84.6 7.86 18.74 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.662 -0.815 . . . . 2.1800000000000002 111.201 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.27 12.24 32.03 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.087 -0.709 . . . . 1.5600000000000001 109.087 171.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -97.27 -152.26 28.45 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.209 -0.905 . . . . 1.54 111.242 175.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.74 153.65 95.54 Favored 'Cis proline' 0 C--N 1.344 0.3 0 CA-C-N 119.088 1.444 . . . . 1.6799999999999999 112.655 -0.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.574 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 98.6 m-85 -103.83 140.65 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.86 -0.609 . . . . 1.28 110.095 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -76.58 -15.73 59.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.464 -0.789 . . . . 3.5099999999999998 110.239 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.94 148.08 25.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.713 -0.676 . . . . 1.52 110.327 -177.045 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.8 t -68.91 -18.66 64.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.074 -0.512 . . . . 1.1799999999999999 111.525 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -57.12 -46.35 82.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.902 0.382 . . . . 2.2400000000000002 110.739 176.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.574 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.2 OUTLIER -63.6 -29.74 70.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.038 -0.528 . . . . 2.2599999999999998 111.367 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.0 t -72.43 -42.1 65.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.722 -0.473 . . . . 1.1899999999999999 109.722 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.84 -46.36 88.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.776 -0.647 . . . . 0.55000000000000004 110.205 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.42 -49.51 67.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.182 -0.917 . . . . 0.56999999999999995 111.673 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.79 82.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.183 0.516 . . . . 0.5 110.788 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.402 HD21 HD13 ' A' ' 33' ' ' LEU . 48.1 mt -69.73 -37.06 76.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 0.45000000000000001 111.086 -179.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -62.91 -38.74 92.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.915 0.388 . . . . 1.22 111.67 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.154 0.502 . . . . 3.0499999999999998 110.988 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 22.6 mmtt -77.41 -46.49 22.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.827 -0.624 . . . . 1.48 111.852 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.47 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 68.6 m -146.11 97.01 4.52 Favored Pre-proline 0 C--N 1.315 -0.918 0 N-CA-C 110.108 -0.33 . . . . 1.1599999999999999 110.108 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 5.7 Cg_endo -47.5 -62.94 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.855 3.036 . . . . 0.57999999999999996 113.553 -167.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 11.2 pt-20 -67.14 -25.55 66.24 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.162 -0.926 . . . . 2.4500000000000002 111.749 -177.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 59' ' ' LEU . 2.0 tm? -74.29 -41.67 60.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.529 -0.915 . . . . 1.4199999999999999 108.529 -177.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.9 -23.71 77.75 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 114.596 -1.183 . . . . 0.37 111.639 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.28 -32.51 71.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.804 0.335 . . . . 0.47999999999999998 110.454 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 67.9 mttm -64.93 -49.85 68.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 2.1699999999999999 110.766 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.27 -29.9 48.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.925 0.393 . . . . 1.1200000000000001 110.348 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.79 -61.66 2.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.539 . . . . 1.7 111.002 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.9 mptt -59.78 -37.07 78.06 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.11 0.481 . . . . 3.96 110.596 -174.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.3 tm? -64.61 -43.7 92.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.123 -0.944 . . . . 1.5 110.278 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 t60 -78.82 -32.97 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.321 -0.622 . . . . 2.3399999999999999 109.321 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.51 98.59 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.12 -0.946 . . . . 0.40000000000000002 111.832 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 61.5 mtm -59.83 -51.08 71.27 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.411 0.624 . . . . 0.71999999999999997 110.06 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 66' ' ' LEU . 97.1 t -57.02 -43.58 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 114.786 -1.097 . . . . 0.79000000000000004 110.687 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.4 mmmt -61.12 -38.84 87.8 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.92 -0.582 . . . . 1.47 111.386 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -63.17 -37.22 86.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.26 0.553 . . . . 1.26 110.801 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.35 -43.37 64.15 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 1.54 110.416 177.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 72.0 mt -67.99 -22.5 27.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.477 0.656 . . . . 0.34000000000000002 110.245 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.04 -36.25 72.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.931 0.872 . . . . 0.34999999999999998 109.851 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.01 -2.08 55.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.301 -1.318 . . . . 0.48999999999999999 110.27 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 8.5 tp -92.01 137.03 32.7 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.70999999999999996 109.605 -176.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.39 156.66 52.21 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.755 -0.736 . . . . 0.76000000000000001 111.964 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -44.29 -41.43 13.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.86 3.04 . . . . 1.5600000000000001 114.235 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -67.43 -50.22 60.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.71 0.291 . . . . 2.52 110.76 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -76.24 -31.35 58.31 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.258 -0.577 . . . . 0.35999999999999999 110.297 -176.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 40.7 ttmt -58.35 -45.58 87.92 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.475 -0.784 . . . . 2.04 111.187 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.12 -40.85 96.17 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.899 -0.667 . . . . 0.40999999999999998 112.177 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.5 t80 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.99 -0.105 . . . . 1.6499999999999999 111.278 177.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -55.51 -44.92 77.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.95 0.405 . . . . 0.40999999999999998 111.657 -175.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 40.6 mt-10 -71.19 -22.26 62.04 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.544 -0.462 . . . . 1.96 110.846 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -79.5 -40.3 30.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.619 -0.264 . . . . 2.1200000000000001 111.249 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.3 p -61.78 -27.04 68.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.061 0.457 . . . . 0.56999999999999995 110.3 176.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -74.34 -50.51 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.918 -0.583 . . . . 1.0900000000000001 110.132 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 42.1 mt-10 -58.23 -53.64 55.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.191 0.441 . . . . 2.8199999999999998 112.191 -177.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.72 -45.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.276 -0.42 . . . . 0.51000000000000001 111.218 -174.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.523 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.63 -40.88 84.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.64000000000000001 110.872 179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -63.5 -31.05 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.87 -0.605 . . . . 4.4199999999999999 110.673 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.14 -36.15 89.82 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.782 -0.723 . . . . 0.66000000000000003 111.896 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.436 HG13 ' CB ' ' A' ' 113' ' ' SER . 43.9 mm -67.66 -50.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.058 0.456 . . . . 0.55000000000000004 110.42 178.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 39.4 pttt -82.12 0.19 41.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.159 -0.473 . . . . 2.7000000000000002 111.646 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.52 -27.99 60.78 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.127 -0.694 . . . . 0.63 109.127 164.226 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.503 ' HA ' ' HG1' ' A' ' 101' ' ' THR . 66.6 mtp180 -86.69 -7.61 58.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.679 -0.691 . . . . 3.1000000000000001 109.579 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -81.89 -41.36 21.05 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.349 -0.611 . . . . 0.96999999999999997 109.349 167.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 32.5 m-85 -63.39 -50.11 71.16 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.201 0.524 . . . . 1.48 110.981 178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.503 ' HG1' ' HA ' ' A' ' 98' ' ' ARG . 17.5 p -66.78 -14.43 62.6 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.321 0.86 . . . . 0.87 113.321 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 94.13 3.43 63.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.689 -0.767 . . . . 1.1599999999999999 113.184 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 37.0 m-80 -98.51 68.31 1.83 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.2 -0.296 . . . . 1.8300000000000001 110.2 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -52.31 119.65 15.47 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.709 -0.678 . . . . 1.75 112.318 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.22 163.38 38.86 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.589 2.859 . . . . 0.53000000000000003 112.722 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 67.3 p -85.77 173.52 9.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.116 -0.493 . . . . 1.48 109.865 174.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -66.59 -27.83 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.19 -0.67 . . . . 2.8799999999999999 109.19 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.43 -40.23 93.66 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.286 -0.87 . . . . 2.2400000000000002 110.782 177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -59.04 -44.71 91.8 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.876 0.37 . . . . 1.73 110.588 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.561 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -67.66 -46.13 73.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.81999999999999995 110.835 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' O ' HG22 ' A' ' 114' ' ' VAL . 61.8 mtpt -55.77 -45.86 78.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.261 0.553 . . . . 1.74 110.101 177.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -62.07 -43.5 98.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.441 -0.799 . . . . 0.46999999999999997 111.692 178.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.436 ' CB ' HG13 ' A' ' 95' ' ' ILE . 57.9 p -64.92 -36.2 83.6 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.002 0.371 . . . . 1.3400000000000001 112.002 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.797 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -78.62 -25.12 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 109.024 -0.732 . . . . 0.65000000000000002 109.024 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 45.5 mttm -61.53 -45.81 92.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.221 -0.899 . . . . 1.72 111.408 176.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.625 ' O ' HD13 ' A' ' 120' ' ' LEU . 22.3 mm-40 -71.01 -38.7 72.63 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.582 -0.447 . . . . 2.27 110.457 -174.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.523 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.9 m -62.85 -38.5 82.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.483 -0.487 . . . . 0.81000000000000005 110.265 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.615 HD13 ' HA ' ' A' ' 149' ' ' ALA . 41.2 mt -78.49 -26.68 46.05 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.079 -0.388 . . . . 1.21 111.358 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -61.98 -48.54 79.88 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.525 -0.917 . . . . 0.94999999999999996 108.525 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -65.78 -43.82 87.62 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.072 -1.422 . . . . 1.0600000000000001 111.667 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.472 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 47.7 t80 -72.03 -37.52 69.73 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 120.315 -0.554 . . . . 1.54 111.291 -170.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' A' ' 118' ' ' LEU . 5.8 mptp? -59.75 -31.97 70.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.47 . . . . 1.98 111.052 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.44 -5.68 59.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.593 -0.731 . . . . 0.69999999999999996 112.608 -174.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -77.39 156.69 31.02 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.048 -0.661 . . . . 0.5 110.389 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.7 t -67.23 152.05 46.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.639 -0.504 . . . . 1.1799999999999999 109.639 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -54.72 -42.42 71.5 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.814 0.34 . . . . 2.21 111.254 -175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.04 -30.39 71.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.41999999999999998 111.044 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.92 -37.46 50.49 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.217 -0.753 . . . . 0.31 111.217 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -63.08 -45.63 91.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.195 0.521 . . . . 1.3200000000000001 109.986 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.59 84.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.426 -0.807 . . . . 0.41999999999999998 111.41 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 134' ' ' LYS . 24.7 t70 -73.84 -30.63 62.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.292 0.567 . . . . 0.55000000000000004 109.774 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -64.52 -26.07 68.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.008 -0.542 . . . . 0.39000000000000001 110.228 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.46 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.96 -14.8 79.99 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 114.243 0.457 . . . . 0.27000000000000002 114.243 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -95.53 -34.18 12.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.518 0.659 . . . . 2.4300000000000002 111.408 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -89.64 -28.73 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.768 -0.651 . . . . 1.8300000000000001 110.695 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -128.9 72.96 81.74 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.296 -0.411 . . . . 0.68999999999999995 110.168 172.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -61.2 -44.76 22.05 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.832 2.355 . . . . 0.63 112.922 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.527 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 34.8 t80 -66.87 -35.6 80.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 2.3100000000000001 111.263 -174.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 56.9 mt -74.01 -44.06 55.82 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.614 -0.434 . . . . 1.02 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.46 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -61.15 -32.72 72.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.409 0.623 . . . . 0.34999999999999998 110.065 176.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.2 tttm -55.18 -70.84 0.09 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.926 -1.034 . . . . 2.5800000000000001 110.963 171.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.487 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.9 m -60.37 -30.29 46.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 112.966 0.728 . . . . 0.5 112.966 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.28 -54.4 14.87 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.248 -0.581 . . . . 0.62 110.657 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -79.22 -19.19 51.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 2.5800000000000001 112.088 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.1 t -85.48 3.45 40.24 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.992 0.425 . . . . 1.3200000000000001 110.58 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 149' ' ' ALA . . . 75.54 16.83 80.39 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.803 -0.713 . . . . 1.0900000000000001 112.804 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -79.45 -62.38 1.71 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.836 0.351 . . . . 1.98 110.112 -178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -70.75 -37.14 73.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.094 -0.503 . . . . 0.34000000000000002 110.006 176.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.615 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -54.56 -37.45 65.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.284 -0.871 . . . . 0.51000000000000001 111.82 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 150' ' ' LYS . 45.3 tptt -82.8 -23.79 33.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.902 0.382 . . . . 2.8199999999999998 110.697 -177.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.42 ' HD2' HG21 ' A' ' 114' ' ' VAL . 50.2 t80 -72.48 -29.16 63.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 0.48999999999999999 109.823 174.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.797 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.62 -35.08 19.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.903 -0.589 . . . . 0.58999999999999997 110.826 176.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 117.82 -36.75 3.54 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.533 -1.027 . . . . 1.6200000000000001 110.533 -172.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 70.76 158.13 0.18 Allowed 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.927 0.891 . . . . 4.1200000000000001 111.513 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.828 -0.606 . . . . 4.0099999999999998 109.443 -176.994 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 86.6 mmm . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.514 0.197 . . . . 23.59 111.451 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -77.94 65.46 3.24 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.949 -0.644 . . . . 22.469999999999999 112.268 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.6 m -96.25 118.51 32.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.989 0.423 . . . . 21.510000000000002 110.467 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 27.1 m -69.53 133.34 47.55 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.934 -0.576 . . . . 20.190000000000001 109.812 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.36 -42.32 75.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.552 . . . . 21.420000000000002 110.788 -177.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -162.65 81.38 0.51 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.886 0.374 . . . . 18.199999999999999 110.473 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -127.87 94.84 4.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.304 -0.407 . . . . 16.059999999999999 110.836 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -162.23 134.3 5.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.958 -0.756 . . . . 13.27 108.958 172.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -112.93 -84.46 0.59 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.785 -0.366 . . . . 12.33 111.093 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 61.6 174.59 0.12 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.889 0.376 . . . . 11.33 111.083 -173.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.8 m 58.91 45.4 15.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.943 -0.571 . . . . 7.9500000000000002 110.826 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 66.3 m -74.28 94.15 2.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.167 0.508 . . . . 7.3600000000000003 111.125 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 95.71 -172.74 30.2 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.954 -0.641 . . . . 4.5700000000000003 111.727 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -82.21 78.77 8.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.288 0.566 . . . . 4.5199999999999996 110.201 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.759 ' SD ' ' HD2' ' A' ' 30' ' ' LYS . 44.6 tpp -86.9 107.14 18.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.448 -0.796 . . . . 2.0 110.526 -179.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 24.1 p90 -78.3 147.27 34.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 1.47 110.855 179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -105.48 136.12 45.63 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.376 -0.601 . . . . 3.1499999999999999 109.376 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -65.23 -35.27 80.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.85 0.357 . . . . 2.3500000000000001 110.737 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -73.1 -5.75 41.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.451 -0.34 . . . . 4.1600000000000001 111.753 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -87.92 -10.93 49.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.401 0.619 . . . . 2.5699999999999998 109.848 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 68.1 mt -79.31 134.69 58.42 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.499 -0.926 . . . . 0.68999999999999995 108.499 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -41.78 113.58 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.184 2.589 . . . . 0.59999999999999998 112.123 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -17.99 65.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.723 -0.671 . . . . 0.56999999999999995 111.768 -172.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 7.4 m-20 -65.27 -31.21 72.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.936 0.874 . . . . 1.3700000000000001 109.426 178.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 75.0 t80 -85.06 -28.89 25.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.036 -1.438 . . . . 0.80000000000000004 110.313 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.495 ' HA ' ' HG2' ' A' ' 14' ' ' MET . 58.7 mtp180 -72.02 -25.05 61.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.84 0.829 . . . . 1.73 108.849 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -71.53 -18.99 62.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.172 -1.376 . . . . 1.02 110.661 174.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 9' ' ' ASP . 72.1 mt -91.39 -48.48 6.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.93000000000000005 111.124 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.495 ' HG2' ' HA ' ' A' ' 11' ' ' ARG . 17.5 ptp -63.23 133.38 95.43 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 120.979 0.419 . . . . 1.1499999999999999 109.994 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD3' HD21 ' A' ' 139' ' ' LEU . 65.8 Cg_endo -74.26 163.81 35.61 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.602 2.201 . . . . 0.90000000000000002 112.385 -175.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -43.83 -41.74 11.88 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.93 2.42 . . . . 0.95999999999999996 112.697 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.7 -34.5 18.87 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.438 -0.801 . . . . 1.8300000000000001 112.122 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.53 -19.25 19.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.717 0.294 . . . . 0.81999999999999995 111.25 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.455 ' HG2' ' SD ' ' A' ' 14' ' ' MET . 19.0 mtm180 -88.46 -42.48 12.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.382 -0.372 . . . . 2.1600000000000001 111.393 -176.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.54 -40.74 60.25 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 123.242 0.339 . . . . 1.0600000000000001 111.832 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.609 ' O ' HD23 ' A' ' 25' ' ' LEU . 32.5 t80 -61.34 -58.97 6.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 119.005 -0.522 . . . . 0.65000000000000002 111.332 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.418 HD11 ' HE1' ' A' ' 100' ' ' TYR . 32.5 mt -73.41 -11.92 60.64 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.814 1.188 . . . . 1.1299999999999999 112.192 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -67.86 -39.29 83.79 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.622 -0.51 . . . . 2.0600000000000001 109.622 164.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -69.96 -50.43 41.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.866 -0.607 . . . . 1.8400000000000001 111.109 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.609 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -59.32 141.97 53.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.31 0.576 . . . . 1.05 111.289 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -141.26 -83.03 0.21 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.491 -0.777 . . . . 1.78 110.456 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.93 158.73 43.8 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.999 -0.741 . . . . 2.3900000000000001 108.999 176.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.52 -51.4 3.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.894 -0.67 . . . . 0.93000000000000005 112.833 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 7.8 m-20 -68.75 -43.89 74.87 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.787 -0.243 . . . . 2.25 111.14 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.759 ' HD2' ' SD ' ' A' ' 0' ' ' MET . 86.0 mttt -61.47 -20.03 62.69 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.0 0.429 . . . . 1.3100000000000001 111.031 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.3 m -63.74 -39.98 95.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.80000000000000004 110.975 177.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.7 p -80.85 -27.04 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 116.186 -0.461 . . . . 0.84999999999999998 110.34 -176.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.572 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.4 mm? -54.49 -56.41 19.11 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.279 -0.419 . . . . 0.97999999999999998 111.329 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -60.93 -25.23 66.63 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.921 0.341 . . . . 2.4100000000000001 111.921 -175.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -74.19 -15.4 61.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.969 0.414 . . . . 1.96 111.339 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 82.6 t -90.38 -48.1 14.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.575 0.702 . . . . 0.97999999999999998 109.317 173.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.572 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 52.6 m-85 -55.1 -45.09 75.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.637 -1.165 . . . . 0.82999999999999996 114.018 176.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.12 14.15 5.41 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.952 -0.699 . . . . 2.1800000000000002 111.557 -176.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.51 -77.25 0.59 Allowed 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.556 -0.747 . . . . 1.5600000000000001 109.846 173.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.508 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 45.82 -150.72 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.795 -0.716 . . . . 1.54 112.684 -174.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.3 Cg_endo -91.84 148.99 16.0 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.096 -1.21 . . . . 1.6799999999999999 111.06 -9.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.508 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 23.4 m-85 -116.79 122.13 43.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.457 0.646 . . . . 1.28 111.067 -171.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.592 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 6.9 ptpp? -88.39 -7.02 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.91 -1.041 . . . . 3.5099999999999998 109.948 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.586 HD21 ' HG3' ' A' ' 47' ' ' GLU . 8.2 p30 -151.83 162.63 40.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.67 -0.696 . . . . 1.52 109.654 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 25.9 m -69.38 -32.66 71.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.392 -0.367 . . . . 1.1799999999999999 111.19 -177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 46.3 mt-10 -59.59 -38.33 80.94 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.073 -0.512 . . . . 2.2400000000000002 111.313 -176.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.592 ' OE1' ' HG2' ' A' ' 43' ' ' LYS . 34.0 mt-10 -57.87 -42.76 85.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.955 0.407 . . . . 2.2599999999999998 111.403 177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -70.99 -37.48 72.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.141 -0.481 . . . . 1.1899999999999999 110.148 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 45' ' ' THR . 69.9 mt -65.98 -42.65 92.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.088 -0.505 . . . . 0.55000000000000004 110.093 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.02 75.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.339 -0.846 . . . . 0.56999999999999995 111.025 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.49 90.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.871 -0.604 . . . . 0.5 110.396 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.552 HD21 HD13 ' A' ' 33' ' ' LEU . 24.9 mt -67.23 -40.76 86.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.135 -0.939 . . . . 0.45000000000000001 111.174 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.51 -32.68 72.72 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.809 0.338 . . . . 1.22 111.004 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -77.27 -46.8 21.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 3.0499999999999998 110.596 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.511 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.1 mmtt -68.52 -49.46 59.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.024 -0.535 . . . . 1.48 111.858 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 m -147.5 92.26 4.85 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 109.853 -0.425 . . . . 1.1599999999999999 109.853 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -37.39 -56.75 0.8 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 124.593 3.529 . . . . 0.57999999999999996 114.096 -172.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.68 -28.89 69.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.409 -0.814 . . . . 2.4500000000000002 112.148 -175.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 33.8 mt -72.63 -37.9 67.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.755 0.788 . . . . 1.4199999999999999 109.022 -178.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.27 -36.41 89.6 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 114.526 -1.215 . . . . 0.37 111.229 174.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.595 ' O ' ' HD3' ' A' ' 65' ' ' LYS . . . -61.15 -41.19 96.31 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.348 -0.241 . . . . 0.47999999999999998 110.348 174.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 42.6 mmtm -50.89 -63.65 1.06 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.261 0.553 . . . . 2.1699999999999999 110.375 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.2 m -67.49 -27.69 39.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.048 -0.978 . . . . 1.1200000000000001 111.747 -172.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.15 -45.85 79.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.826 0.346 . . . . 1.7 111.193 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -76.62 -34.88 58.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.742 0.782 . . . . 3.96 109.448 179.184 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.44 -48.11 68.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.593 -1.185 . . . . 1.5 112.047 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -72.93 -25.92 61.21 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.842 -0.799 . . . . 2.3399999999999999 108.842 -175.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.84 -35.3 80.28 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 114.68 -1.146 . . . . 0.40000000000000002 111.225 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.4 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 36.4 mtm -62.48 -49.96 73.31 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.139 -0.689 . . . . 0.71999999999999997 109.139 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.424 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 67.4 t -54.22 -48.81 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 114.707 -1.133 . . . . 0.79000000000000004 110.268 176.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -63.6 -43.08 97.98 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.485 -0.78 . . . . 1.47 112.403 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.5 m -64.88 -30.53 71.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.855 0.359 . . . . 1.26 111.303 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.5 mtmt -77.79 -36.26 50.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.428 -0.351 . . . . 1.54 110.232 176.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.89 -24.83 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.505 0.669 . . . . 0.34000000000000002 110.319 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.92 70.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.804 0.811 . . . . 0.34999999999999998 109.798 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.47 -0.63 57.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.562 -1.199 . . . . 0.48999999999999999 110.709 -179.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.3 tp -94.79 135.48 36.23 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.851 -0.613 . . . . 0.70999999999999996 109.944 -178.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.44 144.43 48.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.72 -0.752 . . . . 0.76000000000000001 111.929 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -33.8 -43.3 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 125.067 3.845 . . . . 1.5600000000000001 115.199 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -64.76 -52.73 55.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.941 0.4 . . . . 2.52 110.591 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.5 -31.55 53.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.41 0.624 . . . . 0.35999999999999999 109.946 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -57.84 -46.26 85.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.772 -1.104 . . . . 2.04 111.118 176.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.91 -40.2 98.54 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.648 -0.787 . . . . 0.40999999999999998 111.574 177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -65.3 -46.57 79.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.603 -0.299 . . . . 1.6499999999999999 110.804 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.35 -46.0 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.039 0.447 . . . . 0.40999999999999998 111.198 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -60.04 -38.42 82.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.3 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.443 ' HD2' HD11 ' A' ' 91' ' ' ILE . 4.3 tmtp? -77.61 -46.45 22.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.123 -0.231 . . . . 2.1200000000000001 110.65 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 p -63.37 -43.05 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.753 0.311 . . . . 0.56999999999999995 111.165 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -62.03 -40.36 87.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 1.0900000000000001 110.354 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -66.76 -35.52 80.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.493 -0.321 . . . . 2.8199999999999998 111.42 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.443 HD11 ' HD2' ' A' ' 87' ' ' LYS . 94.8 mt -63.87 -45.72 96.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.723 0.297 . . . . 0.51000000000000001 110.513 177.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.683 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -64.95 -42.44 94.62 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.697 -0.482 . . . . 0.64000000000000001 109.697 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -59.48 -34.06 72.09 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.556 -0.747 . . . . 4.4199999999999999 111.265 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.69 -39.55 86.13 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.958 -0.639 . . . . 0.66000000000000003 112.287 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.467 HD11 ' OG ' ' A' ' 113' ' ' SER . 29.6 mm -66.45 -49.67 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.166 0.508 . . . . 0.55000000000000004 109.672 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.5 ptmm? -83.87 36.01 0.54 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.61 0.719 . . . . 2.7000000000000002 110.114 175.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.1 -32.92 3.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.949 -1.023 . . . . 0.63 109.842 165.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -88.0 -3.48 58.9 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.137 -0.483 . . . . 3.1000000000000001 110.315 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 28.2 m-85 -88.32 -31.23 19.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.16 0.505 . . . . 0.96999999999999997 109.778 166.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.454 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 4.5 m-85 -66.74 -34.57 78.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.722 -0.672 . . . . 1.48 111.765 -176.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 p -73.63 -0.42 15.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.756 -0.657 . . . . 0.87 112.644 -174.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.86 9.48 64.03 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.688 -0.768 . . . . 1.1599999999999999 111.945 -175.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -105.28 177.3 4.89 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.851 -0.426 . . . . 1.8300000000000001 109.851 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 56.8 mt-10 -141.59 100.65 6.13 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.611 -0.268 . . . . 1.75 111.396 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.452 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 9.6 Cg_endo -56.96 132.83 54.07 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 121.987 1.791 . . . . 0.53000000000000003 110.078 167.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -76.03 173.51 11.18 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.313 -0.555 . . . . 1.48 110.157 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 86.0 tttt -60.13 -33.12 71.71 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.767 -0.373 . . . . 2.8799999999999999 110.366 -175.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -58.32 -40.87 83.2 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.819 -0.628 . . . . 2.2400000000000002 110.864 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.02 -47.55 84.8 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.124 -0.489 . . . . 1.73 110.544 177.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.498 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.7 mp -65.4 -45.98 81.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.715 -0.675 . . . . 0.81999999999999995 110.713 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 151' ' ' PHE . 59.9 mtpt -55.16 -51.32 66.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.03 0.443 . . . . 1.74 110.481 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.554 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -60.96 -41.26 96.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.543 -0.753 . . . . 0.46999999999999997 111.2 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.467 ' OG ' HD11 ' A' ' 95' ' ' ILE . 50.4 m -65.13 -43.08 93.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.216 -0.447 . . . . 1.3400000000000001 112.04 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.517 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.2 m -76.15 -29.88 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.596 0.712 . . . . 0.65000000000000002 109.646 -176.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.4 ptmt -72.47 -26.11 61.68 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.13 -0.941 . . . . 1.72 110.624 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.569 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.8 tt0 -76.83 -33.7 57.93 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 109.262 -0.644 . . . . 2.27 109.262 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 114' ' ' VAL . 93.6 t -58.42 -47.72 87.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.424 0.63 . . . . 0.81000000000000005 110.198 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.582 ' O ' ' HG3' ' A' ' 122' ' ' LYS . 7.7 mt -69.41 -26.14 64.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.62 -0.718 . . . . 1.21 110.37 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 34.3 ttpt -62.62 -43.99 97.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.677 -0.86 . . . . 0.94999999999999996 108.677 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.77 -45.95 66.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.839 -1.073 . . . . 1.0600000000000001 111.841 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -36.12 70.99 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 118.929 -1.108 . . . . 1.54 111.833 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 29.8 mttp -64.39 -30.3 71.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.057 0.456 . . . . 1.98 110.49 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -6.38 58.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 0.69999999999999996 112.352 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.6 mtm -77.37 158.38 30.13 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.224 -0.591 . . . . 0.5 110.317 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.5 m -65.15 152.11 44.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.338 -0.245 . . . . 1.1799999999999999 110.338 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -57.18 -42.15 80.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.725 0.298 . . . . 2.21 111.181 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.2 -29.65 70.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.41999999999999998 110.956 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.25 -38.66 53.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.942 -0.572 . . . . 0.31 111.932 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -61.51 -45.54 93.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.474 0.654 . . . . 1.3200000000000001 109.514 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.18 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.05 -0.977 . . . . 0.41999999999999998 110.966 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -74.24 -34.35 63.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.047 -0.524 . . . . 0.55000000000000004 109.669 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.06 -34.03 76.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.722 -0.672 . . . . 0.39000000000000001 110.098 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.43 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -63.9 -22.3 66.4 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.94 -0.573 . . . . 0.27000000000000002 113.318 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -85.81 -19.38 30.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 2.4300000000000002 111.386 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -105.45 -37.2 6.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 1.8300000000000001 110.991 -177.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.424 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 77.8 m-85 -129.23 73.58 81.59 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.932 0.396 . . . . 0.68999999999999995 110.059 175.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.47 -30.78 72.08 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.885 2.39 . . . . 0.63 112.388 -175.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 36.2 t80 -69.63 -39.53 77.09 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.439 . . . . 2.3100000000000001 110.242 -178.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.465 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 71.0 mt -77.62 -44.14 29.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.301 -0.408 . . . . 1.02 110.75 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.43 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.29 -39.03 74.91 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.744 -0.465 . . . . 0.34999999999999998 109.744 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.571 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.2 tttt -45.62 -71.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.04 -0.982 . . . . 2.5800000000000001 111.444 171.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -67.06 -25.24 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.489 -0.778 . . . . 0.5 112.706 -172.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.465 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 23.0 m-30 -75.03 -54.52 7.02 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.755 -0.778 . . . . 0.62 110.125 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -64.69 -31.3 72.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 2.5800000000000001 111.777 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 15.7 m -84.9 0.19 51.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.794 0.33 . . . . 1.3200000000000001 111.471 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.97 79.06 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.774 -0.727 . . . . 1.0900000000000001 112.648 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -69.43 -47.33 64.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.94 0.4 . . . . 1.98 110.102 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.95 -30.49 61.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.149 -0.478 . . . . 0.34000000000000002 110.589 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.541 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -58.58 -39.55 80.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.51000000000000001 111.725 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -79.87 -29.54 40.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.78 -0.368 . . . . 2.8199999999999998 110.8 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 111' ' ' LYS . 66.7 t80 -66.56 -33.01 74.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.177 0.513 . . . . 0.48999999999999999 109.656 172.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.517 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -67.74 -25.59 65.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.349 -0.841 . . . . 0.58999999999999997 111.03 177.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 88.68 15.15 60.23 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.558 -0.746 . . . . 1.6200000000000001 112.013 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.442 ' HG2' ' HB3' ' A' ' 152' ' ' ALA . 6.3 pt-20 -115.83 165.87 12.6 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.98 -0.129 . . . . 4.1200000000000001 110.72 -177.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 28.5 m120 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 119.262 -0.399 . . . . 4.0099999999999998 111.409 168.823 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.905 0.383 . . . . 23.59 110.524 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 147.98 64.1 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.709 -0.757 . . . . 22.469999999999999 112.241 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 19.5 p -71.26 144.11 50.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.555 0.217 . . . . 21.510000000000002 110.93 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 64.9 p 51.74 41.1 28.84 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.509 0.724 . . . . 20.190000000000001 111.94 178.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -70.67 142.07 51.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 21.420000000000002 110.21 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -129.56 148.02 51.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.058 0.456 . . . . 18.199999999999999 111.667 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -122.69 45.65 2.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.832 0.825 . . . . 16.059999999999999 108.994 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 19.7 t-80 -78.44 9.45 3.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.908 -1.042 . . . . 13.27 111.236 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -84.95 -12.45 53.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.874 -0.417 . . . . 12.33 109.874 177.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 67.26 174.03 0.26 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.287 -0.87 . . . . 11.33 111.179 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.5 t 55.91 57.9 4.82 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.465 0.65 . . . . 7.9500000000000002 110.38 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 10.2 p -78.65 132.06 36.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.861 -0.609 . . . . 7.3600000000000003 111.032 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 100.4 -122.61 7.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.964 -0.636 . . . . 4.5700000000000003 111.815 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -134.17 98.25 4.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.055 0.455 . . . . 4.5199999999999996 110.297 177.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 17.7 ttm -104.76 77.41 1.35 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.959 -0.564 . . . . 2.0 110.175 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -68.94 156.33 38.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.708 -0.678 . . . . 1.47 109.821 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -105.7 149.45 26.37 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.968 -0.382 . . . . 3.1499999999999999 109.968 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -54.47 -45.55 73.2 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.921 0.391 . . . . 2.3500000000000001 111.233 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.54 16.34 1.39 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.477 0.547 . . . . 4.1600000000000001 112.477 -176.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -86.12 -8.56 57.78 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.647 -0.872 . . . . 2.5699999999999998 108.647 171.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.8 mt -85.62 129.27 55.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.947 -1.024 . . . . 0.68999999999999995 109.0 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -42.34 114.77 0.42 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.311 2.674 . . . . 0.59999999999999998 112.442 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.61 -23.96 65.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.82 -0.627 . . . . 0.56999999999999995 111.928 -174.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.32 -35.94 82.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.724 0.773 . . . . 1.3700000000000001 110.022 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -82.16 -20.24 38.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.655 -1.157 . . . . 0.80000000000000004 110.945 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -72.35 -20.24 61.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.266 -0.642 . . . . 1.73 109.266 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.4 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 6.4 t70 -74.71 -23.69 58.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.844 -1.071 . . . . 1.02 109.745 174.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.42 HD11 ' HG2' ' A' ' 147' ' ' LYS . 10.0 mp -83.6 -44.28 14.76 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 114.998 -1.001 . . . . 0.93000000000000005 110.33 173.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.505 ' SD ' ' HE3' ' A' ' 96' ' ' LYS . 46.4 ttp -68.14 128.7 93.22 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.111 -0.949 . . . . 1.1499999999999999 111.443 -173.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -64.89 149.61 89.3 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.142 2.561 . . . . 0.90000000000000002 112.808 -175.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 71.9 Cg_exo -51.89 -27.95 29.58 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.096 3.197 . . . . 0.95999999999999996 113.04 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -64.48 -57.42 9.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.26 0.553 . . . . 1.8300000000000001 109.584 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 -28.33 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.797 -0.638 . . . . 0.81999999999999995 110.577 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -68.89 -40.72 79.03 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.8 -0.636 . . . . 2.1600000000000001 110.758 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.67 -53.1 60.7 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.378 0.511 . . . . 1.0600000000000001 112.378 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 69.1 t80 -57.21 -41.78 80.1 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.458 0.54 . . . . 0.65000000000000002 112.458 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 25' ' ' LEU . 91.6 mt -88.85 -13.79 38.41 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 118.955 0.798 . . . . 1.1299999999999999 111.402 177.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -65.45 -42.39 92.4 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.241 -0.652 . . . . 2.0600000000000001 109.241 164.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -68.1 -53.24 26.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.331 -0.849 . . . . 1.8400000000000001 111.26 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.448 HD22 ' CB ' ' A' ' 29' ' ' ASP . 14.0 mt -56.17 129.91 42.08 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.545 0.688 . . . . 1.05 111.12 -177.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 m -143.47 -83.43 0.16 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.797 -1.092 . . . . 1.78 110.926 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.4 142.87 44.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.522 -0.308 . . . . 2.3900000000000001 110.651 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.81 -45.1 3.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.946 -0.645 . . . . 0.93000000000000005 112.959 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.561 ' O ' HG12 ' A' ' 32' ' ' VAL . 5.2 m-20 -57.02 -47.32 81.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 2.25 110.696 -177.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 mmtm -57.08 -31.21 65.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.833 -0.621 . . . . 1.3100000000000001 111.35 -174.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -67.8 -32.05 72.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.585 . . . . 0.80000000000000004 111.473 -178.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 29' ' ' ASP . 4.7 p -95.18 -28.05 4.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.048 -0.523 . . . . 0.84999999999999998 111.722 -172.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.464 HD12 ' HE2' ' A' ' 37' ' ' PHE . 4.0 mm? -55.8 -45.95 78.13 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.707 0.262 . . . . 0.97999999999999998 111.707 175.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -62.15 -30.44 71.05 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.66 0.266 . . . . 2.4100000000000001 111.303 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -69.51 -37.06 77.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.331 -0.395 . . . . 1.96 110.611 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 86.8 t -71.97 -51.88 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.5 0.666 . . . . 0.97999999999999998 110.233 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.675 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 24.0 m-85 -59.93 -41.47 91.84 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.068 1.507 . . . . 0.82999999999999996 115.068 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -80.25 2.18 25.53 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.628 -0.829 . . . . 2.1800000000000002 111.293 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -98.07 -80.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.708 -0.678 . . . . 1.5600000000000001 109.623 172.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.44 -157.98 0.63 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.761 -0.733 . . . . 1.54 112.96 -172.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -93.88 153.29 14.77 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.042 -1.232 . . . . 1.6799999999999999 111.49 -7.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 25.7 m-85 -117.41 132.22 56.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.032 -0.531 . . . . 1.28 110.864 -173.043 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 22.2 pttp -87.91 -12.71 43.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.481 -0.781 . . . . 3.5099999999999998 109.907 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.552 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -159.84 151.79 20.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.617 -0.719 . . . . 1.52 109.532 -179.308 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.8 m -60.1 -22.02 62.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.615 . . . . 1.1799999999999999 112.037 -174.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.02 -40.24 80.33 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.816 0.341 . . . . 2.2400000000000002 110.801 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.3 mt-10 -64.77 -31.51 72.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 2.2599999999999998 111.086 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.3 t -75.61 -37.63 59.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 1.1899999999999999 109.831 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.11 -42.89 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.55000000000000004 109.655 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.06 -49.28 76.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.047 -0.979 . . . . 0.56999999999999995 111.361 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.85 95.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.848 -0.614 . . . . 0.5 110.669 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.28 -35.41 76.02 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 115.443 -0.799 . . . . 0.45000000000000001 111.43 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -65.39 -36.61 84.48 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.028 0.442 . . . . 1.22 110.814 175.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -66.75 -50.15 63.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 3.0499999999999998 110.363 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HB3' HG21 ' A' ' 32' ' ' VAL . 43.0 mmtt -66.55 -55.34 15.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 1.48 111.915 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.6 t -139.92 95.47 8.62 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 110.199 -0.297 . . . . 1.1599999999999999 110.199 -175.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.16 -58.94 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.922 3.081 . . . . 0.57999999999999996 113.424 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.35 -29.49 70.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.231 -0.895 . . . . 2.4500000000000002 112.064 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.83 -40.6 68.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.28 -1.007 . . . . 1.4199999999999999 108.28 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.99 -31.39 78.42 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.37 111.683 175.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.12 -43.08 68.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.28 -0.267 . . . . 0.47999999999999998 110.28 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -58.68 -45.16 90.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.255 -0.43 . . . . 2.1699999999999999 111.323 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.41 -33.3 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.284 . . . . 1.1200000000000001 111.121 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.03 -52.72 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.657 -0.247 . . . . 1.7 111.152 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -59.52 -36.49 76.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.43 0.633 . . . . 3.96 110.153 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.461 ' C ' HD13 ' A' ' 66' ' ' LEU . 2.4 tm? -66.44 -45.95 78.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.896 -1.047 . . . . 1.5 110.461 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -77.0 -27.62 54.73 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.357 -0.609 . . . . 2.3399999999999999 109.357 -171.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.91 96.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.223 -0.899 . . . . 0.40000000000000002 111.461 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 49.6 mtm -59.37 -51.3 70.49 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.712 0.768 . . . . 0.71999999999999997 109.32 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.6 t -52.41 -48.32 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 CA-C-N 114.121 -1.4 . . . . 0.79000000000000004 110.474 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 9.5 mmmm -61.6 -41.15 97.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.422 -0.808 . . . . 1.47 111.814 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 t -58.7 -40.68 84.32 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.093 0.473 . . . . 1.26 110.787 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.8 mttm -74.01 -41.69 61.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.905 -0.588 . . . . 1.54 110.691 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.457 HD11 HD12 ' A' ' 89' ' ' ILE . 64.2 mt -68.2 -24.5 30.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.379 0.609 . . . . 0.34000000000000002 110.662 177.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -39.66 71.56 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.667 -0.697 . . . . 0.34999999999999998 109.969 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.83 -46.52 62.58 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.939 -1.028 . . . . 0.48999999999999999 109.973 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 135' ' ' GLN . 7.1 tp -40.62 132.68 2.12 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 114.858 -1.064 . . . . 0.70999999999999996 112.723 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 159.71 49.34 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.562 -0.745 . . . . 0.76000000000000001 112.306 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -46.83 -41.12 25.32 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.795 2.997 . . . . 1.5600000000000001 113.722 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.4 -53.81 46.51 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.266 0.555 . . . . 2.52 110.393 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.553 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -78.02 -29.13 49.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.731 -0.668 . . . . 0.35999999999999999 111.099 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 25.8 ttpp -58.01 -42.52 85.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.722 -0.672 . . . . 2.04 110.53 176.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.35 -42.53 98.9 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.732 -0.747 . . . . 0.40999999999999998 111.676 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.458 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.6 t80 -65.94 -46.06 79.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.445 0.164 . . . . 1.6499999999999999 110.962 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.019 0.437 . . . . 0.40999999999999998 111.363 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.93 -23.37 65.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 1.96 111.209 -176.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -85.93 -49.81 7.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.448 -0.342 . . . . 2.1200000000000001 110.942 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.3 p -62.21 -40.71 97.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.327 -0.397 . . . . 0.56999999999999995 111.272 -176.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.457 HD12 HD11 ' A' ' 74' ' ' ILE . 43.5 mt -62.11 -37.15 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 116.172 -0.467 . . . . 1.0900000000000001 111.322 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -69.59 -36.71 76.48 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.768 -0.373 . . . . 2.8199999999999998 110.717 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.11 -48.85 86.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.325 0.584 . . . . 0.51000000000000001 109.801 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.8 68.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.592 -0.731 . . . . 0.64000000000000001 111.1 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.2 -41.41 99.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 4.4199999999999999 110.133 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -67.45 -32.45 79.17 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.059 -0.591 . . . . 0.66000000000000003 112.409 -177.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mm -61.13 -43.32 96.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.0 0.429 . . . . 0.55000000000000004 110.911 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.505 ' HE3' ' SD ' ' A' ' 14' ' ' MET . 3.5 mppt? -100.57 15.79 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.002 0.43 . . . . 2.7000000000000002 110.529 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.675 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -93.34 -31.1 14.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.661 -0.699 . . . . 0.63 109.22 168.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.579 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 14.4 ptm180 -86.36 -1.49 57.58 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.842 -0.617 . . . . 3.1000000000000001 109.941 173.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -81.16 -26.76 35.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.037 -0.727 . . . . 0.96999999999999997 109.037 164.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.596 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 24.0 m-85 -75.18 -48.89 21.37 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.404 0.621 . . . . 1.48 110.353 177.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 26.7 p -67.43 -15.6 63.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 0.87 112.906 -173.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.12 32.84 10.13 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.821 -0.704 . . . . 1.1599999999999999 112.401 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.66 61.71 1.4 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.705 -0.48 . . . . 1.8300000000000001 109.705 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.533 ' H ' ' CD ' ' A' ' 104' ' ' GLU . 4.8 mp0 -45.5 119.67 4.53 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-N 115.205 -0.907 . . . . 1.75 111.999 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 35.8 Cg_endo -67.7 153.63 75.47 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.57 2.18 . . . . 0.53000000000000003 111.629 175.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 108' ' ' ASP . 9.1 t -93.35 175.71 6.66 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.564 -0.902 . . . . 1.48 108.564 173.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 31.5 mtmt -62.71 -33.8 75.85 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.487 -0.485 . . . . 2.8799999999999999 110.199 -175.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.432 ' H ' HG23 ' A' ' 106' ' ' THR . 3.4 m-20 -58.95 -38.65 79.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.455 -0.793 . . . . 2.2400000000000002 111.197 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . 0.402 ' OD2' HG22 ' A' ' 106' ' ' THR . 37.1 m-20 -61.23 -44.16 97.71 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.023 -0.362 . . . . 1.73 110.023 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -67.59 -42.66 82.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.753 -0.658 . . . . 0.81999999999999995 110.749 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.9 mtpm? -55.61 -48.19 75.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.258 0.551 . . . . 1.74 110.325 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.48 93.06 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.31 -0.859 . . . . 0.46999999999999997 111.412 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 79.5 p -64.79 -38.38 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.172 0.434 . . . . 1.3400000000000001 112.172 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 152' ' ' ALA . 13.7 m -77.6 -23.65 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.847 0.832 . . . . 0.65000000000000002 109.362 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -63.96 -41.14 97.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.778 -1.101 . . . . 1.72 110.987 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.44 ' O ' HD13 ' A' ' 120' ' ' LEU . 18.1 mm-40 -72.32 -33.71 67.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.583 -0.447 . . . . 2.27 110.608 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.2 m -68.44 -34.41 65.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.546 -0.462 . . . . 0.81000000000000005 110.676 177.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 114' ' ' VAL . 3.1 mm? -70.7 -33.24 70.68 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.926 -0.484 . . . . 1.21 109.963 173.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.4 ttpt -60.71 -46.02 91.97 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.146 -0.687 . . . . 0.94999999999999996 109.146 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.93 -47.82 60.89 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.963 -1.017 . . . . 1.0600000000000001 111.804 175.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.458 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 70.3 t80 -70.18 -35.82 74.23 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.872 -0.731 . . . . 1.54 111.745 -167.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HE3' HD12 ' A' ' 118' ' ' LEU . 75.4 mttt -67.59 -27.32 66.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.884 0.373 . . . . 1.98 111.088 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.96 -7.58 58.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.944 -0.571 . . . . 0.69999999999999996 112.43 -176.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 41.2 mtm -75.68 159.25 31.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.433 -0.507 . . . . 0.5 111.047 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 m -63.43 143.33 57.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.359 -0.382 . . . . 1.1799999999999999 110.66 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -56.32 -46.23 79.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.607 0.241 . . . . 2.21 111.425 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.51 74.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.004 0.431 . . . . 0.41999999999999998 110.949 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.77 -35.77 58.43 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.683 -0.69 . . . . 0.31 111.761 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -66.71 -42.18 86.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.345 0.593 . . . . 1.3200000000000001 110.071 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.55 -29.88 68.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 0.41999999999999998 110.687 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -76.19 -32.33 58.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.227 0.537 . . . . 0.55000000000000004 109.785 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.6 -30.91 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.39000000000000001 109.698 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' A' ' 137' ' ' PRO . . . -75.7 0.69 60.59 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.759 -0.655 . . . . 0.27000000000000002 112.724 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -99.07 -28.99 13.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.581 0.705 . . . . 2.4300000000000002 109.584 175.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 50.4 mm-40 -97.95 -42.28 7.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.136 -0.938 . . . . 1.8300000000000001 110.147 -176.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -135.22 70.59 68.65 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.162 -0.472 . . . . 0.68999999999999995 110.11 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 133' ' ' GLY . 36.8 Cg_endo -65.88 -19.84 58.39 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.864 2.376 . . . . 0.63 112.632 -176.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 23.1 t80 -65.86 -37.82 87.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.378 -0.374 . . . . 2.3100000000000001 110.564 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.604 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -78.46 -44.71 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.905 -0.405 . . . . 1.02 109.905 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.15 -32.66 66.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.456 0.646 . . . . 0.34999999999999998 109.961 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.5 tttt -54.5 -74.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.563 -1.199 . . . . 2.5800000000000001 111.155 170.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.97 -28.21 43.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 112.944 0.72 . . . . 0.5 112.944 -173.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.604 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 19.7 m-30 -66.32 -55.28 16.73 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.517 -0.473 . . . . 0.62 110.139 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.9 -27.89 60.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.325 -0.852 . . . . 2.5800000000000001 111.383 -175.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 35.6 t -63.89 -26.95 68.83 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.531 -0.544 . . . . 1.3200000000000001 109.531 174.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 104.47 -5.02 44.02 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.818 -0.706 . . . . 1.0900000000000001 112.557 177.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.42 ' HG2' HD11 ' A' ' 13' ' ' LEU . 51.7 tttp -62.74 -56.33 18.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.789 0.328 . . . . 1.98 111.084 -176.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 13' ' ' LEU . . . -62.79 -36.49 83.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.34000000000000002 110.632 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -57.0 -51.26 69.97 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.51000000000000001 110.668 175.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 73.0 mmtt -59.95 -42.71 94.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.369 -0.378 . . . . 2.8199999999999998 111.007 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -59.95 -35.16 74.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.437 0.637 . . . . 0.48999999999999999 110.043 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.34 -7.99 56.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.565 -0.743 . . . . 0.58999999999999997 111.891 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 93.51 13.7 54.94 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.895 -0.669 . . . . 1.6200000000000001 111.771 -176.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 70.28 111.6 0.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.131 0.972 . . . . 4.1200000000000001 111.4 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.248 -0.882 . . . . 4.0099999999999998 110.557 178.558 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 109.892 -0.411 . . . . 23.59 109.892 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -141.62 -122.07 1.78 Allowed Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.824 -0.703 . . . . 22.469999999999999 111.857 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.1 t 72.63 -60.51 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.523 0.729 . . . . 21.510000000000002 110.748 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 23.3 t 55.73 57.64 5.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.435 0.636 . . . . 20.190000000000001 110.959 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -119.3 112.41 19.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.959 -0.564 . . . . 21.420000000000002 109.98 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -80.82 140.67 35.31 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.144 -0.48 . . . . 18.199999999999999 110.484 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -116.75 57.62 0.78 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.927 -0.578 . . . . 16.059999999999999 109.926 178.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -72.94 103.74 3.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.788 -0.642 . . . . 13.27 109.71 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -169.28 127.86 0.99 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.121 -1.437 . . . . 12.33 107.121 -172.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -73.89 49.91 0.34 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.011 0.745 . . . . 11.33 113.011 -168.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 34.2 m -156.82 33.19 0.3 Allowed 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.533 -1.284 . . . . 7.9500000000000002 107.533 173.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 26' ' ' SER . 22.8 t -121.54 -42.76 2.42 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.464 0.913 . . . . 7.3600000000000003 113.464 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -2' ' ' GLY . . . . . 0.795 ' N ' ' H ' ' A' ' 29' ' ' ASP . . . -158.38 -119.35 0.56 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 120.252 -0.975 . . . . 4.5700000000000003 115.299 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -1' ' ' HIS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -142.45 -161.76 1.3 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.977 -1.307 . . . . 4.5199999999999996 110.344 -174.942 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 0' ' ' MET . . . . . 0.407 ' N ' ' SD ' ' A' ' 0' ' ' MET . 0.0 OUTLIER -78.37 -26.82 46.74 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.455 -0.943 . . . . 2.0 108.455 174.237 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.821 ' CE1' ' HD3' ' A' ' 30' ' ' LYS . 2.2 p90 -90.21 144.49 25.81 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.49 -0.777 . . . . 1.47 109.628 172.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.431 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 3.3 mmmp? -117.62 -173.43 2.42 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 3.1499999999999999 109.818 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.508 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 77.5 t80 -69.62 -38.95 77.42 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.584 -0.895 . . . . 2.3500000000000001 108.584 173.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 1.7 mp0 -63.59 -26.21 68.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.487 -1.233 . . . . 4.1600000000000001 111.628 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -78.43 -17.83 55.82 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.898 0.38 . . . . 2.5699999999999998 110.969 -176.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.78 126.12 78.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 108.412 -0.959 . . . . 0.68999999999999995 108.412 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -42.12 114.05 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.328 2.685 . . . . 0.59999999999999998 113.041 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.43 -25.73 62.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.479 -0.782 . . . . 0.56999999999999995 111.792 -176.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -62.27 -38.73 90.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 122.043 0.925 . . . . 1.3700000000000001 109.677 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -80.94 -33.8 33.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.117 -1.401 . . . . 0.80000000000000004 111.238 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -66.48 -22.62 66.19 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.509 0.671 . . . . 1.73 109.235 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -72.85 -10.34 59.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.485 -1.234 . . . . 1.02 111.631 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -100.64 -42.33 6.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.689 0.281 . . . . 0.93000000000000005 111.55 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.466 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 25.9 ptt? -76.03 144.2 75.26 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.988 0.423 . . . . 1.1499999999999999 110.962 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.35 156.05 55.12 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.133 2.555 . . . . 0.90000000000000002 113.623 -172.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -42.41 -47.57 7.28 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.735 2.957 . . . . 0.95999999999999996 114.262 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.559 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.6 pm0 -56.56 -45.41 81.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.788 0.267 . . . . 1.8300000000000001 111.687 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.37 -16.04 62.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.191 0.52 . . . . 0.81999999999999995 110.992 -178.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.466 ' HD2' ' O ' ' A' ' 14' ' ' MET . 32.0 mtp180 -90.98 -32.31 16.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.795 -0.639 . . . . 2.1600000000000001 110.076 177.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 18.0 t70 -56.26 -49.32 74.54 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.67 -0.696 . . . . 1.0600000000000001 111.86 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.575 ' O ' HD23 ' A' ' 25' ' ' LEU . 60.1 t80 -54.45 -57.54 10.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.43 -0.35 . . . . 0.65000000000000002 111.349 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.612 HD21 ' OH ' ' A' ' 100' ' ' TYR . 88.6 mt -78.08 -6.69 55.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 119.06 0.846 . . . . 1.1299999999999999 112.062 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 29.9 tt0 -68.66 -34.67 76.09 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.009 0.433 . . . . 2.0600000000000001 110.077 163.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -77.93 -54.48 6.26 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.176 -0.466 . . . . 1.8400000000000001 110.954 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.575 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.3 mm? -55.27 132.02 46.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 1.05 110.488 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.585 ' H ' ' C ' ' A' ' -3' ' ' SER . 38.5 m -137.37 -88.0 0.28 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 120.507 -0.477 . . . . 1.78 112.206 -172.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.698 ' C ' ' H ' ' A' ' -2' ' ' GLY . 15.5 p-10 -132.58 119.41 20.45 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.898 0.38 . . . . 2.3900000000000001 111.096 174.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.62 -46.94 1.07 Allowed Glycine 0 CA--C 1.542 1.765 0 N-CA-C 115.459 0.944 . . . . 0.93000000000000005 115.459 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.795 ' H ' ' N ' ' A' ' -2' ' ' GLY . 0.3 OUTLIER -95.2 -6.84 40.72 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.206 1.558 . . . . 2.25 115.206 -170.822 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.821 ' HD3' ' CE1' ' A' ' 1' ' ' PHE . 90.7 mttt -80.59 -15.89 55.49 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.024 -1.102 . . . . 1.3100000000000001 108.024 171.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -61.2 -31.59 71.36 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.567 -1.197 . . . . 0.80000000000000004 110.235 175.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.571 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.5 p -89.95 -23.98 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 115.983 -0.553 . . . . 0.84999999999999998 110.594 -178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.54 HD13 HD21 ' A' ' 52' ' ' LEU . 3.7 mm? -54.3 -52.41 61.57 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.194 0.198 . . . . 0.97999999999999998 111.065 170.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -62.11 -29.59 70.44 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.681 0.277 . . . . 2.4100000000000001 111.235 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.69 -41.89 99.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.04 -0.527 . . . . 1.96 110.348 175.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.622 HG12 ' OH ' ' A' ' 42' ' ' TYR . 63.7 t -68.42 -49.68 63.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.295 0.569 . . . . 0.97999999999999998 110.147 177.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.67 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.0 m-85 -55.4 -49.32 72.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 114.138 1.162 . . . . 0.82999999999999996 114.138 177.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -77.38 -5.46 49.77 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.937 -0.705 . . . . 2.1800000000000002 111.262 -174.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -90.02 -76.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.942 -0.572 . . . . 1.5600000000000001 109.559 169.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.63 -155.34 1.55 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.299 -0.476 . . . . 1.54 112.881 -175.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -98.49 154.65 7.43 Favored 'Cis proline' 0 N--CA 1.454 -0.826 0 CA-C-N 118.472 1.136 . . . . 1.6799999999999999 111.938 -7.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.622 ' OH ' HG12 ' A' ' 36' ' ' VAL . 1.0 OUTLIER -104.8 124.78 50.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.176 0.513 . . . . 1.28 110.71 -175.626 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -89.79 -13.62 36.28 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.684 -0.858 . . . . 3.5099999999999998 108.684 171.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.1 p30 -148.69 149.87 32.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.831 -1.077 . . . . 1.52 108.51 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 t -70.31 -16.28 62.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.004 0.431 . . . . 1.1799999999999999 110.887 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.606 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 32.3 tt0 -60.13 -36.73 78.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.933 -0.576 . . . . 2.2400000000000002 110.267 175.117 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -60.88 -38.85 87.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.212 -0.449 . . . . 2.2599999999999998 111.051 177.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.5 t -64.97 -41.7 95.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.229 -0.442 . . . . 1.1899999999999999 110.11 178.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.499 HD11 ' ND1' ' A' ' 67' ' ' HIS . 78.0 mt -66.28 -48.4 81.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.192 -0.458 . . . . 0.55000000000000004 110.641 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.53 76.44 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.577 -0.738 . . . . 0.56999999999999995 111.899 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.83 -38.64 82.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.171 0.51 . . . . 0.5 110.738 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.54 HD21 HD13 ' A' ' 33' ' ' LEU . 20.2 mt -72.6 -33.46 66.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.669 -0.696 . . . . 0.45000000000000001 111.462 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -66.29 -26.38 67.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.031 0.443 . . . . 1.22 110.833 175.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -77.44 -50.21 13.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.759 -0.655 . . . . 3.0499999999999998 110.532 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 32' ' ' VAL . 33.7 mmtt -65.38 -59.87 3.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.601 -0.727 . . . . 1.48 111.981 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.6 t -138.51 99.41 8.66 Favored Pre-proline 0 C--N 1.316 -0.869 0 C-N-CA 120.472 -0.491 . . . . 1.1599999999999999 110.811 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -40.3 -57.95 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.944 3.096 . . . . 0.57999999999999996 113.176 -172.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -56.59 -35.61 68.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.49 -1.232 . . . . 2.4500000000000002 111.933 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.419 HD11 ' HB3' ' A' ' 29' ' ' ASP . 53.9 mt -76.11 -41.32 50.61 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 119.575 -0.85 . . . . 1.4199999999999999 109.23 -174.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.446 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -61.58 -35.14 90.68 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.42 -1.263 . . . . 0.37 111.801 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.6 68.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.92 0.39 . . . . 0.47999999999999998 110.425 174.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 2.7 tppt? -67.22 -47.4 70.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.948 -0.569 . . . . 2.1699999999999999 110.768 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.478 HG23 HH21 ' A' ' 93' ' ' ARG . 13.4 p -69.65 -26.7 31.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.182 0.515 . . . . 1.1200000000000001 110.376 176.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -64.56 -52.98 54.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.63 -0.714 . . . . 1.7 110.954 176.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 66' ' ' LEU . 45.3 pttt -65.7 -30.59 71.3 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.727 -0.842 . . . . 3.96 108.727 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.95 -0.03 12.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 114.391 -1.277 . . . . 1.5 110.389 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.499 ' ND1' HD11 ' A' ' 49' ' ' ILE . 13.5 m80 -113.64 -48.25 2.94 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 115.843 -0.617 . . . . 2.3399999999999999 110.201 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.55 76.85 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.173 0.434 . . . . 0.40000000000000002 112.173 -178.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 44.0 mtm -66.63 -47.7 71.76 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.239 0.542 . . . . 0.71999999999999997 110.433 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.466 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 93.8 t -62.31 -41.85 93.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.424 -0.807 . . . . 0.79000000000000004 110.161 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 8.0 mmmm -63.26 -30.78 71.85 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 115.157 -0.929 . . . . 1.47 111.417 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 40.7 t -62.37 -43.31 99.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.289 0.566 . . . . 1.26 110.553 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -69.54 -39.02 77.7 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.343 -0.614 . . . . 1.54 109.343 177.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.536 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 75.1 mt -77.16 -14.37 14.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.652 0.739 . . . . 0.34000000000000002 111.148 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.74 -34.32 27.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.831 0.824 . . . . 0.34999999999999998 109.325 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.65 -0.68 57.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.972 -1.467 . . . . 0.48999999999999999 110.084 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.417 HD12 ' OD2' ' A' ' 131' ' ' ASP . 13.6 tp -91.4 138.39 31.62 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.462 -0.79 . . . . 0.70999999999999996 109.827 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.08 151.23 27.18 Favored Glycine 0 C--O 1.227 -0.3 0 CA-C-N 115.928 -0.578 . . . . 0.76000000000000001 112.537 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -43.52 -42.72 11.05 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.921 3.081 . . . . 1.5600000000000001 114.179 -176.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' H ' ' CD ' ' A' ' 80' ' ' GLU . 0.3 OUTLIER -81.02 -41.89 21.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.592 -0.276 . . . . 2.52 111.417 -177.085 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.22 82.3 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.568 0.699 . . . . 0.35999999999999999 109.935 178.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.536 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 28.6 ttpp -53.54 -48.22 69.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.596 -1.184 . . . . 2.04 111.389 174.209 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.7 -39.69 91.6 Favored Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.798 -0.715 . . . . 0.40999999999999998 112.191 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -67.34 -46.63 72.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.643 0.258 . . . . 1.6499999999999999 110.869 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.01 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.088 0.471 . . . . 0.40999999999999998 111.413 -177.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 41.2 mt-10 -65.71 -23.94 66.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.768 -0.651 . . . . 1.96 111.492 -176.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -93.98 -42.72 8.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 116.736 -0.211 . . . . 2.1200000000000001 111.359 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.3 p -60.38 -45.08 94.8 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.737 0.304 . . . . 0.56999999999999995 111.037 -177.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.592 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 1.7 mp -56.49 -40.13 66.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 1.0900000000000001 110.481 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -74.74 -35.08 62.63 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.121 0.415 . . . . 2.8199999999999998 112.121 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.537 HG22 ' OG ' ' A' ' 113' ' ' SER . 65.4 mt -63.84 -48.26 87.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.034 0.445 . . . . 0.51000000000000001 109.834 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.7 -30.03 70.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.699 -0.682 . . . . 0.64000000000000001 110.712 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.592 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 11.5 ttt85 -70.49 -40.58 73.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.302 -0.863 . . . . 4.4199999999999999 110.67 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.71 -32.29 83.67 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 121.255 -0.498 . . . . 0.66000000000000003 112.328 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.7 mm -62.63 -44.53 99.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.275 0.559 . . . . 0.55000000000000004 110.715 177.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 36.7 mtmm -91.74 8.85 35.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.903 -0.59 . . . . 2.7000000000000002 110.275 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.67 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -97.02 -33.15 11.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.781 -0.645 . . . . 0.63 109.61 171.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.418 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 13.8 ptp180 -83.51 -3.34 57.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.161 -0.681 . . . . 3.1000000000000001 109.161 172.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.492 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.112 -0.699 . . . . 0.96999999999999997 109.112 164.345 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' HD21 ' A' ' 22' ' ' LEU . 26.9 m-85 -70.17 -48.53 56.87 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.033 -0.53 . . . . 1.48 110.97 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.5 p -62.15 -19.97 63.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.289 -0.869 . . . . 0.87 112.722 -173.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.39 1.72 40.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.695 -0.764 . . . . 1.1599999999999999 112.208 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -101.41 60.32 0.9 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.648 -0.501 . . . . 1.8300000000000001 109.648 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 48.4 mt-10 -50.77 116.11 6.64 Favored Pre-proline 0 C--O 1.234 0.251 0 O-C-N 123.817 0.698 . . . . 1.75 111.691 -173.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 31.6 Cg_endo -64.57 157.16 56.81 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 123.49 2.793 . . . . 0.53000000000000003 113.324 -174.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.416 ' O ' HD13 ' A' ' 110' ' ' LEU . 75.3 p -87.86 178.0 6.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.524 -0.307 . . . . 1.48 110.31 174.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.64 -25.49 65.76 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.126 0.489 . . . . 2.8799999999999999 109.972 175.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' HA ' ' HG2' ' A' ' 111' ' ' LYS . 23.3 m-20 -71.11 -30.84 67.03 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.917 -0.583 . . . . 2.2400000000000002 110.541 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.15 -46.48 80.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.19 0.519 . . . . 1.73 109.802 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' THR . 10.2 mp -64.91 -47.89 76.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.601 -0.727 . . . . 0.81999999999999995 111.691 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 108' ' ' ASP . 16.0 ptpt -60.89 -38.5 85.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.912 0.387 . . . . 1.74 110.283 -177.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.21 75.27 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.926 -0.579 . . . . 0.46999999999999997 111.229 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.537 ' OG ' HG22 ' A' ' 91' ' ' ILE . 24.7 t -55.33 -48.01 74.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.986 -0.552 . . . . 1.3400000000000001 110.925 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.619 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.6 m -77.29 -28.04 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.547 0.689 . . . . 0.65000000000000002 109.534 -176.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 22.2 ttmm -59.11 -44.82 92.01 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.208 -0.905 . . . . 1.72 111.675 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.485 ' O ' HD13 ' A' ' 120' ' ' LEU . 20.3 mt-10 -71.14 -34.32 70.9 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.026 -0.67 . . . . 2.27 111.253 -176.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.1 m -68.89 -22.41 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 C-N-CA 120.365 -0.534 . . . . 0.81000000000000005 109.728 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 149' ' ' ALA . 22.0 mt -83.44 -36.82 23.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.483 -0.326 . . . . 1.21 110.485 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.62 -39.53 80.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.615 0.722 . . . . 0.94999999999999996 109.293 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -73.11 -48.74 33.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.896 -1.047 . . . . 1.0600000000000001 112.165 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.626 ' CE2' ' HB3' ' A' ' 143' ' ' PHE . 0.0 OUTLIER -70.59 -35.52 73.07 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 119.011 -1.075 . . . . 1.54 111.234 -168.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -61.72 -33.12 73.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.006 0.431 . . . . 1.98 110.59 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.09 -1.7 57.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.69999999999999996 112.464 -176.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.577 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 50.8 mtm -74.82 157.81 34.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.333 -0.547 . . . . 0.5 111.076 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.5 m -63.21 149.08 46.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.148 -0.478 . . . . 1.1799999999999999 110.368 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -59.34 -43.28 92.78 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.543 0.211 . . . . 2.21 111.534 -174.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.41 -25.96 68.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.836 0.35 . . . . 0.41999999999999998 111.046 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.76 -36.79 31.85 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.801 -0.714 . . . . 0.31 111.608 177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.577 ' HE3' ' O ' ' A' ' 124' ' ' MET . 97.5 mttt -65.46 -45.57 83.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.449 0.643 . . . . 1.3200000000000001 110.014 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.31 -41.27 94.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.091 -0.958 . . . . 0.41999999999999998 111.652 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.417 ' OD2' HD12 ' A' ' 77' ' ' LEU . 38.7 t70 -71.55 -31.47 67.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.059 0.457 . . . . 0.55000000000000004 109.853 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -61.86 -29.09 69.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.865 -0.607 . . . . 0.39000000000000001 110.148 173.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . 0.411 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -72.73 -22.15 79.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.98 -0.629 . . . . 0.27000000000000002 112.737 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -81.87 -35.39 29.35 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.716 0.769 . . . . 2.4300000000000002 109.867 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 32.6 mm-40 -89.86 -36.88 14.82 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.521 -1.218 . . . . 1.8300000000000001 110.794 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.466 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 48.7 m-85 -130.21 79.27 73.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.022 0.439 . . . . 0.68999999999999995 110.408 175.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.98 -37.75 32.05 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 123.146 2.564 . . . . 0.63 113.141 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 41.6 t80 -69.3 -38.05 78.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.814 0.34 . . . . 2.3100000000000001 110.592 -175.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.3 mt -75.58 -44.02 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.02 110.956 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.411 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.76 -37.51 76.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.988 0.423 . . . . 0.34999999999999998 109.961 177.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 16.9 tppt? -48.1 -69.51 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.212 -0.903 . . . . 2.5800000000000001 111.532 171.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.8 m -63.57 -27.45 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 115.372 -0.831 . . . . 0.5 112.569 -174.031 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 22.7 m-30 -74.79 -54.12 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.065 -0.654 . . . . 0.62 110.263 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.79 -32.45 73.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 2.5800000000000001 111.941 -176.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.2 t -75.24 -7.9 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.511 -0.313 . . . . 1.3200000000000001 110.859 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.7 13.17 83.81 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.867 -0.683 . . . . 1.0900000000000001 111.774 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.37 -56.09 9.73 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.972 0.415 . . . . 1.98 110.525 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.82 70.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.952 -0.567 . . . . 0.34000000000000002 110.073 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -61.25 -36.82 81.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.46 -0.791 . . . . 0.51000000000000001 111.137 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.06 -32.76 61.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 2.8199999999999998 110.169 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -68.51 -31.33 70.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.92 -0.582 . . . . 0.48999999999999999 109.901 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.496 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.6 -15.85 62.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.961 -0.563 . . . . 0.58999999999999997 110.851 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 89.65 31.77 10.98 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.839 -0.619 . . . . 1.6200000000000001 113.101 176.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -160.36 -168.2 2.1 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 117.256 0.528 . . . . 4.1200000000000001 111.425 176.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.477 ' HB2' ' HB1' ' A' ' 149' ' ' ALA . 19.5 m120 . . . . . 0 C--O 1.248 1.007 0 C-N-CA 123.568 0.747 . . . . 4.0099999999999998 110.706 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 14.0 tmm? . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 109.456 -0.572 . . . . 23.59 109.456 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 105.21 104.92 2.98 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.72 -0.753 . . . . 22.469999999999999 111.839 -178.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 5.3 p -77.61 -18.5 56.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.088 0.47 . . . . 21.510000000000002 110.442 178.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 14.5 m 58.25 30.95 20.22 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.09 -0.959 . . . . 20.190000000000001 112.536 170.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -93.31 -20.27 20.55 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.054 -0.259 . . . . 21.420000000000002 111.049 -178.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -80.62 81.89 6.77 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.888 -0.412 . . . . 18.199999999999999 109.888 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.83 -21.59 60.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.019 -0.734 . . . . 16.059999999999999 109.019 177.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -136.78 141.54 42.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.027 -0.988 . . . . 13.27 108.631 172.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 64.31 90.2 0.09 Allowed 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.682 0.614 . . . . 12.33 110.692 -177.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -85.98 -161.39 0.62 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.987 -0.551 . . . . 11.33 110.209 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 14.8 m -60.32 122.67 15.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.763 0.316 . . . . 7.9500000000000002 111.039 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.8 m -79.64 66.72 5.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.196 0.522 . . . . 7.3600000000000003 110.303 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 122.39 -147.67 16.97 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-N 115.714 -0.675 . . . . 4.5700000000000003 111.534 -177.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 62.0 m80 -97.92 115.55 28.36 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.168 -0.308 . . . . 4.5199999999999996 110.168 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 2.4 mmt -96.57 111.35 23.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.547 0.689 . . . . 2.0 112.08 -178.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.524 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 13.6 p90 -95.55 154.27 17.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.309 -0.859 . . . . 1.47 109.029 173.293 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.488 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 4.2 mmmp? -129.32 171.72 12.21 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.667 0.27 . . . . 3.1499999999999999 110.906 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.615 ' OH ' ' HD2' ' A' ' 19' ' ' ARG . 87.1 t80 -56.97 -41.32 78.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.508 0.67 . . . . 2.3500000000000001 109.89 175.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.488 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 2.1 mp0 -64.35 -24.5 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.809 -1.087 . . . . 4.1600000000000001 111.999 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -82.91 -14.67 53.75 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.561 -0.456 . . . . 2.5699999999999998 110.649 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.6 mt -82.18 128.9 66.03 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.222 -0.658 . . . . 0.68999999999999995 109.222 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -42.49 115.18 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.573 2.849 . . . . 0.59999999999999998 112.763 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -21.67 66.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.56999999999999995 112.112 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.35 -37.07 82.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.792 0.806 . . . . 1.3700000000000001 109.685 178.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -80.91 -28.76 35.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.396 -1.274 . . . . 0.80000000000000004 111.127 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 14.8 mtm180 -69.46 -21.28 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.723 -0.473 . . . . 1.73 109.723 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.467 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 13.3 t70 -65.68 -21.14 66.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.313 -0.858 . . . . 1.02 110.52 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.2 mt -89.41 -12.43 40.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.947 -0.57 . . . . 0.93000000000000005 110.937 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 68.1 mtm -95.35 129.2 35.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.029 0.442 . . . . 1.1499999999999999 110.531 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.474 ' HB2' ' OE1' ' A' ' 17' ' ' GLU . 38.3 Cg_endo -66.67 153.02 79.46 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.858 2.372 . . . . 0.90000000000000002 112.53 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -42.97 -47.14 8.51 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.384 2.723 . . . . 0.95999999999999996 113.882 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 15' ' ' PRO . 1.6 pm0 -60.81 -45.3 94.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.661 0.267 . . . . 1.8300000000000001 111.609 -178.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -28.46 69.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.81999999999999995 110.856 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.615 ' HD2' ' OH ' ' A' ' 3' ' ' TYR . 45.3 mtm105 -89.11 -29.03 19.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.924 -0.58 . . . . 2.1600000000000001 111.132 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 28.4 t70 -56.02 -38.84 71.07 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.419 0.628 . . . . 1.0600000000000001 111.134 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.606 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.2 t80 -57.71 -58.78 6.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.55 -0.75 . . . . 0.65000000000000002 110.985 174.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.468 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.0 mt -75.04 -7.82 54.78 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 119.456 1.026 . . . . 1.1299999999999999 111.941 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.462 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 6.3 tp60 -67.57 -41.63 83.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.247 0.546 . . . . 2.0600000000000001 110.187 162.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -73.8 -52.46 13.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.585 -0.734 . . . . 1.8400000000000001 110.838 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -50.61 121.36 5.69 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.632 1.206 . . . . 1.05 112.737 -177.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.711 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 15.6 m -141.17 -169.43 2.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 112.547 -2.115 . . . . 1.78 107.938 178.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -57.13 144.05 36.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 118.28 0.491 . . . . 2.3900000000000001 111.026 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.9 -58.18 0.63 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.799 -0.715 . . . . 0.93000000000000005 112.248 -178.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.653 ' O ' HG12 ' A' ' 32' ' ' VAL . 40.9 m-20 -87.12 -30.95 20.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.571 0.224 . . . . 2.25 111.29 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.711 ' HG3' ' O ' ' A' ' 26' ' ' SER . 3.0 mtpm? -69.75 -17.97 63.48 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.659 -0.651 . . . . 1.3100000000000001 110.072 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.434 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 9.9 m -64.75 -36.24 83.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.894 -1.048 . . . . 0.80000000000000004 110.823 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.661 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 12.2 p -81.99 -32.02 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 116.183 -0.462 . . . . 0.84999999999999998 112.147 -174.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.587 HD13 HD21 ' A' ' 52' ' ' LEU . 4.4 mm? -55.08 -42.74 73.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.348 . . . . 0.97999999999999998 110.062 175.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.42 ' NZ ' ' HB3' ' A' ' 34' ' ' LYS . 3.7 ttpm? -63.29 -29.01 70.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.427 0.632 . . . . 2.4100000000000001 110.341 -178.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 31' ' ' THR . 9.8 mm-40 -79.26 -45.33 19.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.232 -0.895 . . . . 1.96 110.769 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 32' ' ' VAL . 12.0 m -75.79 -37.0 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 112.276 0.473 . . . . 0.97999999999999998 112.276 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -62.12 -43.97 97.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.812 1.042 . . . . 0.82999999999999996 113.812 171.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -80.51 -17.48 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.694 -0.803 . . . . 2.1800000000000002 110.57 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.58 -77.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 1.5600000000000001 109.904 168.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.78 -147.16 2.37 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 121.058 -0.591 . . . . 1.54 112.558 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -91.22 123.14 4.82 Favored 'Cis proline' 0 N--CA 1.457 -0.654 0 CA-C-N 118.747 1.274 . . . . 1.6799999999999999 110.541 -12.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 21.4 m-85 -99.04 116.95 32.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.55 0.69 . . . . 1.28 111.873 -169.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -71.02 -15.88 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.708 -1.133 . . . . 3.5099999999999998 111.422 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 46' ' ' GLU . 9.1 p30 -147.2 164.45 33.12 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.156 -0.313 . . . . 1.52 110.156 -174.106 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -73.18 -32.22 64.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 1.1799999999999999 111.918 -176.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.435 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 50.1 mt-10 -58.36 -41.81 85.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.565 0.222 . . . . 2.2400000000000002 111.051 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.3 OUTLIER -61.98 -33.51 74.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.588 -0.278 . . . . 2.2599999999999998 111.529 176.629 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.4 m -71.69 -40.29 69.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.27 0.557 . . . . 1.1899999999999999 109.821 177.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.84 -44.86 98.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.34 -0.845 . . . . 0.55000000000000004 110.266 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.578 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -55.9 -49.24 73.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.368 -0.833 . . . . 0.56999999999999995 111.255 175.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB1' ' CG1' ' A' ' 36' ' ' VAL . . . -53.33 -41.6 65.89 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.987 -0.551 . . . . 0.5 111.017 178.423 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 33' ' ' LEU . 63.3 mt -70.54 -40.82 73.19 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.801 -0.636 . . . . 0.45000000000000001 111.199 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -62.89 -33.64 75.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.08 0.4 . . . . 1.22 112.08 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 33.4 mmtp -71.91 -28.44 63.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.393 -0.367 . . . . 3.0499999999999998 111.463 -177.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -99.02 -50.53 4.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.08 0.466 . . . . 1.48 110.818 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 t -127.42 93.67 40.2 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.697 -0.853 . . . . 1.1599999999999999 108.697 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.93 -53.31 7.28 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.798 2.998 . . . . 0.57999999999999996 112.63 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 17.1 tp10 -57.34 -37.68 72.94 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 114.481 -1.236 . . . . 2.4500000000000002 111.655 177.095 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 29' ' ' ASP . 1.6 tt -70.04 -45.78 66.42 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.246 -1.02 . . . . 1.4199999999999999 108.246 -174.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.417 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.88 -32.43 84.14 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 114.235 -1.348 . . . . 0.37 111.865 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.78 81.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.809 0.338 . . . . 0.47999999999999998 110.528 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 96.2 mttt -62.72 -53.02 60.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.087 -0.506 . . . . 2.1699999999999999 110.836 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.417 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.7 p -67.61 -28.71 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.489 -0.323 . . . . 1.1200000000000001 111.203 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -62.04 -60.02 4.22 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 110.096 -0.335 . . . . 1.7 110.096 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.647 ' O ' ' HG3' ' A' ' 69' ' ' MET . 70.8 mmtt -64.14 -36.64 84.69 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.298 0.57 . . . . 3.96 109.827 -176.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 21' ' ' PHE . 15.1 tp -63.24 -38.79 92.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.94 -1.027 . . . . 1.5 110.648 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -81.62 -33.34 31.53 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.746 -0.661 . . . . 2.3399999999999999 109.62 -175.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.69 -36.56 83.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.222 -0.899 . . . . 0.40000000000000002 111.185 177.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.647 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 26.6 mtm -63.38 -54.15 41.31 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.203 0.525 . . . . 0.71999999999999997 109.918 176.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.2 t -54.74 -40.77 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.296 -0.866 . . . . 0.79000000000000004 110.108 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.66 -40.73 92.76 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.77 -1.105 . . . . 1.47 111.207 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.3 m -57.57 -37.69 73.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 1.26 110.721 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.8 mttm -67.45 -46.69 72.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 1.54 110.31 176.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.88 -29.29 42.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.005 0.431 . . . . 0.34000000000000002 111.698 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.33 -37.47 85.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.487 0.66 . . . . 0.34999999999999998 109.956 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.61 -1.47 56.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.789 -1.096 . . . . 0.48999999999999999 111.152 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 132' ' ' PHE . 8.9 tp -92.85 134.99 34.54 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.169 -0.469 . . . . 0.70999999999999996 109.857 -176.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.63 149.83 51.58 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.599 -0.81 . . . . 0.76000000000000001 111.846 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -39.05 -36.33 0.7 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 124.381 3.387 . . . . 1.5600000000000001 114.452 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.88 -56.03 18.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.335 0.588 . . . . 2.52 109.68 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.94 -29.99 35.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.664 -0.698 . . . . 0.35999999999999999 110.807 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -61.74 -38.85 89.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.578 -0.737 . . . . 2.04 110.86 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.57 -40.24 95.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.584 -0.817 . . . . 0.40999999999999998 111.443 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 32.7 t80 -67.79 -49.88 59.96 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.837 -0.181 . . . . 1.6499999999999999 111.223 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.97 -51.89 59.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.945 0.403 . . . . 0.40999999999999998 112.004 -176.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -71.06 -27.7 63.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.335 -0.393 . . . . 1.96 111.359 -175.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.495 ' O ' ' HB3' ' A' ' 90' ' ' GLU . 58.7 tttp -84.08 -39.48 19.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.552 0.215 . . . . 2.1200000000000001 111.049 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 p -65.24 -46.09 82.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.795 0.331 . . . . 0.56999999999999995 110.228 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.84 -31.59 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.017 -0.538 . . . . 1.0900000000000001 110.339 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.495 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 9.3 tp10 -61.91 -47.56 84.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.884 0.374 . . . . 2.8199999999999998 110.269 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.465 HG22 ' OG ' ' A' ' 113' ' ' SER . 71.9 mt -63.09 -46.86 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.51000000000000001 110.398 178.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.413 ' O ' ' HD2' ' A' ' 96' ' ' LYS . . . -64.33 -35.97 82.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.827 -0.624 . . . . 0.64000000000000001 110.829 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.451 ' HA ' ' HD3' ' A' ' 96' ' ' LYS . 46.1 mtm180 -62.18 -41.46 98.35 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.795 -0.639 . . . . 4.4199999999999999 110.813 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.525 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -60.82 -33.94 85.08 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.768 -0.729 . . . . 0.66000000000000003 112.013 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.5 mm -64.0 -43.42 97.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.598 0.237 . . . . 0.55000000000000004 111.508 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.506 ' HB3' ' HZ2' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -93.48 -9.47 38.31 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 119.916 -0.714 . . . . 2.7000000000000002 110.753 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.21 78.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.056 0.455 . . . . 0.63 109.891 170.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 12.1 ptm180 -85.23 3.43 39.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 3.1000000000000001 110.043 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.2 m-85 -90.42 -45.51 8.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.037 -0.727 . . . . 0.96999999999999997 109.037 162.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.524 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 35.2 m-85 -59.63 -34.25 72.55 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 1.48 111.785 -177.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.5 p -71.73 -2.66 18.26 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.404 0.52 . . . . 0.87 112.404 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 92.58 31.64 8.68 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.807 -0.711 . . . . 1.1599999999999999 112.304 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 44.7 m-80 -130.8 176.23 8.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.53 -0.545 . . . . 1.8300000000000001 109.53 -178.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 49.8 mt-10 -142.73 106.87 5.43 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 111.654 0.242 . . . . 1.75 111.654 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.4 Cg_endo -59.17 160.29 19.58 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.834 2.356 . . . . 0.53000000000000003 111.886 173.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 72.2 p -86.1 165.15 16.83 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.127 -0.694 . . . . 1.48 109.127 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 8.7 ptpp? -61.97 -23.72 66.56 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.334 -0.546 . . . . 2.8799999999999999 109.88 177.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.412 ' HA ' ' HD2' ' A' ' 111' ' ' LYS . 16.4 m-20 -72.27 -32.43 66.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.693 -0.685 . . . . 2.2400000000000002 110.937 178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -62.98 -41.29 99.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.421 0.629 . . . . 1.73 109.694 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.425 ' O ' HG13 ' A' ' 114' ' ' VAL . 7.5 mp -66.19 -41.07 90.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.229 -0.896 . . . . 0.81999999999999995 110.413 177.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 93.5 mttt -54.49 -52.72 61.04 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.959 0.409 . . . . 1.74 109.939 174.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -59.84 -43.34 94.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.611 -0.722 . . . . 0.46999999999999997 111.143 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.506 ' O ' HG13 ' A' ' 117' ' ' VAL . 44.2 t -55.93 -48.84 74.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 1.3400000000000001 111.667 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.774 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.0 m -80.95 -24.85 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.616 0.722 . . . . 0.65000000000000002 110.056 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 37.7 ttmt -66.63 -41.5 88.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 1.72 111.333 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.458 ' O ' HD13 ' A' ' 120' ' ' LEU . 12.7 mm-40 -71.87 -35.46 69.81 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.57 -0.452 . . . . 2.27 110.706 -178.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.37 -33.16 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.678 -0.409 . . . . 0.81000000000000005 110.251 176.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.559 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 85.1 mt -72.78 -34.85 67.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.038 -0.356 . . . . 1.21 110.038 176.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.01 -43.8 95.0 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.148 -0.686 . . . . 0.94999999999999996 109.148 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -69.83 -48.07 60.36 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.123 -0.944 . . . . 1.0600000000000001 111.498 174.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.623 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 37.9 t80 -69.61 -37.92 77.07 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.878 -0.729 . . . . 1.54 111.702 -168.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -61.07 -33.02 72.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.828 0.347 . . . . 1.98 111.097 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -87.36 -8.03 57.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.746 0.647 . . . . 0.69999999999999996 112.746 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -74.3 159.71 32.06 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.275 -0.57 . . . . 0.5 111.558 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -59.26 145.06 44.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.067 -0.515 . . . . 1.1799999999999999 110.494 173.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.91 -43.39 98.92 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.275 -0.42 . . . . 2.21 111.999 -174.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.4 -29.74 70.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.41999999999999998 110.656 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.99 -36.27 57.29 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.563 -0.744 . . . . 0.31 111.602 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.623 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 98.9 mttt -63.6 -45.98 87.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.336 0.588 . . . . 1.3200000000000001 110.061 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.32 74.56 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.443 -0.799 . . . . 0.41999999999999998 111.431 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -74.21 -31.95 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.601 -0.518 . . . . 0.55000000000000004 109.601 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.42 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.9 t80 -60.11 -34.22 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.699 -0.682 . . . . 0.39000000000000001 109.811 172.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.15 -10.42 78.2 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.27000000000000002 113.202 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -87.72 -29.34 21.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.351 0.596 . . . . 2.4300000000000002 110.268 177.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.5 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -100.98 -37.81 8.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.192 -0.913 . . . . 1.8300000000000001 111.046 -176.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -128.05 71.47 78.94 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.907 0.384 . . . . 0.68999999999999995 110.073 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -62.44 -36.66 64.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.045 2.496 . . . . 0.63 112.427 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.528 ' O ' HG13 ' A' ' 142' ' ' VAL . 61.7 t80 -64.31 -41.62 96.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.46 -0.336 . . . . 2.3100000000000001 110.344 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.445 HD21 ' HD3' ' A' ' 15' ' ' PRO . 94.9 mt -72.02 -44.68 63.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.486 -0.325 . . . . 1.02 110.333 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -57.19 -40.71 77.92 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.95 -0.389 . . . . 0.34999999999999998 109.95 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 22.6 ttpp -46.25 -71.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.323 -0.853 . . . . 2.5800000000000001 111.193 172.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.1 m -62.83 -26.51 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.658 -0.701 . . . . 0.5 112.259 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -74.51 -41.64 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.848 -0.741 . . . . 0.62 110.488 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 37.3 mt-10 -79.68 -31.71 41.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.747 0.308 . . . . 2.5800000000000001 111.073 -178.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 57.3 m -70.18 -10.76 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 1.3200000000000001 111.224 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 79.41 14.99 80.78 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.853 -0.689 . . . . 1.0900000000000001 111.547 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.467 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 54.8 tptt -69.49 -59.9 2.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.805 0.336 . . . . 1.98 110.585 -177.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.28 75.46 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.132 0.491 . . . . 0.34000000000000002 109.781 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.559 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -59.32 -45.61 90.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.342 -0.845 . . . . 0.51000000000000001 111.136 178.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -67.47 -39.81 85.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.317 -0.401 . . . . 2.8199999999999998 110.405 -178.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -59.81 -39.53 85.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.917 -0.583 . . . . 0.48999999999999999 110.537 176.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.774 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -73.2 -21.13 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.49 . . . . 0.58999999999999997 111.515 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 84.41 9.67 81.3 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.447 -1.061 . . . . 1.6200000000000001 110.447 -171.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 65.2 168.08 0.19 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 122.069 0.938 . . . . 4.1200000000000001 112.527 -175.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 . . . . . 0 C--O 1.248 1.015 0 CA-C-N 114.543 -1.208 . . . . 4.0099999999999998 110.098 -176.408 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.699 0.285 . . . . 23.59 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 70.63 -166.3 51.57 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.929 -0.653 . . . . 22.469999999999999 112.155 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 5.9 p -149.0 -78.93 0.14 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.62 0.248 . . . . 21.510000000000002 111.139 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 32.4 t -122.58 -43.05 2.29 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.083 -0.247 . . . . 20.190000000000001 111.166 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -68.66 -66.84 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.317 . . . . 21.420000000000002 111.16 -176.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -127.41 115.81 19.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.781 0.324 . . . . 18.199999999999999 110.746 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -148.34 35.99 0.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.171 0.51 . . . . 16.059999999999999 110.49 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -82.58 176.44 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 13.27 109.885 175.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 59.4 m80 58.15 48.81 12.3 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.913 -0.403 . . . . 12.33 109.913 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 28.2 p-80 -77.09 60.23 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.619 0.723 . . . . 11.33 111.298 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 9.0 p -155.18 136.43 13.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.8 -1.091 . . . . 7.9500000000000002 109.066 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.6 p -49.13 -58.11 5.53 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 123.548 0.53 . . . . 7.3600000000000003 112.047 -172.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 153.41 -49.81 0.51 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 111.524 -0.63 . . . . 4.5700000000000003 111.524 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -81.05 69.69 7.71 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.275 -0.639 . . . . 4.5199999999999996 109.275 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 84.1 mmm -87.88 134.35 33.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.557 -0.747 . . . . 2.0 109.751 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -77.67 146.21 36.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.103 0.478 . . . . 1.47 110.116 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 10.5 mtmp? -121.62 155.65 34.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.964 -0.562 . . . . 3.1499999999999999 109.676 177.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.733 ' CE1' ' HB3' ' A' ' 22' ' ' LEU . 47.6 m-85 -83.79 -0.16 49.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.07 0.938 . . . . 2.3500000000000001 109.592 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -84.16 -19.79 33.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.94 -1.482 . . . . 4.1600000000000001 108.881 170.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 9.8 m-20 -96.76 -14.58 21.87 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.88 -0.6 . . . . 2.5699999999999998 110.344 -174.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.08 130.69 71.74 Favored Pre-proline 0 N--CA 1.449 -0.491 0 N-CA-C 108.601 -0.889 . . . . 0.68999999999999995 108.601 176.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -40.5 106.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.342 2.694 . . . . 0.59999999999999998 112.533 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.79 -22.3 66.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.574 -0.739 . . . . 0.56999999999999995 111.474 -174.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -63.91 -29.26 70.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.918 0.866 . . . . 1.3700000000000001 109.559 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 40.4 t80 -91.8 -27.92 17.69 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.178 -1.374 . . . . 0.80000000000000004 110.723 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' HD2' ' SD ' ' A' ' 14' ' ' MET . 7.3 mmm180 -68.13 -23.8 64.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.336 0.589 . . . . 1.73 109.544 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.6 -30.12 71.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.989 -1.005 . . . . 1.02 110.587 173.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.581 HD22 HG21 ' A' ' 142' ' ' VAL . 13.6 mt -82.34 -14.94 54.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.961 -0.563 . . . . 0.93000000000000005 110.246 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.411 ' SD ' ' HD2' ' A' ' 11' ' ' ARG . 66.9 mtt -71.16 130.19 88.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 1.1499999999999999 110.616 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 23.7 Cg_exo -63.48 126.62 18.02 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.267 1.978 . . . . 0.90000000000000002 111.683 176.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -40.33 -48.78 4.06 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.963 3.109 . . . . 0.95999999999999996 114.571 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -75.99 -24.17 55.32 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.814 0.301 . . . . 1.8300000000000001 111.814 -175.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.34 54.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.265 -0.643 . . . . 0.81999999999999995 109.265 174.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -71.61 -29.71 64.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.221 -0.899 . . . . 2.1600000000000001 110.242 173.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -49.49 -53.72 21.67 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.849 0.718 . . . . 1.0600000000000001 110.798 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.542 ' O ' ' HB2' ' A' ' 24' ' ' ASN . 87.6 t80 -52.88 -62.11 1.86 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.054 -0.521 . . . . 0.65000000000000002 111.723 178.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.733 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 36.5 mt -69.25 -20.14 63.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 118.856 0.753 . . . . 1.1299999999999999 111.821 -177.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -64.7 -31.81 73.19 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 119.187 0.903 . . . . 2.0600000000000001 110.91 166.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 21' ' ' PHE . 0.9 OUTLIER -68.11 -47.65 67.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.073 -0.512 . . . . 1.8400000000000001 112.178 179.505 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.495 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.2 mm? -59.53 140.54 56.19 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.32 0.581 . . . . 1.05 111.177 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 t -122.53 -68.56 0.88 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.221 -0.9 . . . . 1.78 111.463 -174.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -151.13 -70.51 0.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.016 0.376 . . . . 2.3900000000000001 112.016 -174.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.36 -27.3 72.96 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.105 -0.569 . . . . 0.93000000000000005 112.687 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.1 p30 -73.84 -35.66 64.82 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.892 0.377 . . . . 2.25 110.843 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.95 -30.06 71.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.006 0.432 . . . . 1.3100000000000001 110.929 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 44.3 m -56.28 -43.86 79.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.656 -0.702 . . . . 0.80000000000000004 111.223 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.12 -28.55 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.957 -0.565 . . . . 0.84999999999999998 110.39 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -55.79 -46.72 77.9 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 121.119 0.485 . . . . 0.97999999999999998 109.799 168.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.486 ' HG2' ' HE3' ' A' ' 38' ' ' LYS . 37.2 ttmt -57.06 -29.92 63.83 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.326 -0.852 . . . . 2.4100000000000001 110.665 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -78.92 -34.18 44.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 1.96 111.232 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 78.4 t -71.29 -49.51 47.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.246 0.546 . . . . 0.97999999999999998 110.478 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.542 ' HE2' ' CD2' ' A' ' 100' ' ' TYR . 35.4 m-85 -57.43 -24.63 56.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.174 0.805 . . . . 0.82999999999999996 113.174 176.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE3' ' HG2' ' A' ' 34' ' ' LYS . 9.7 mtmp? -101.42 14.68 31.22 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.966 -0.694 . . . . 2.1800000000000002 110.911 176.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.86 23.33 10.75 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.086 -0.506 . . . . 1.5600000000000001 110.747 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.64 -149.86 9.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.88 -0.676 . . . . 1.54 111.852 174.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.0 162.94 86.45 Favored 'Cis proline' 0 N--CA 1.462 -0.346 0 CA-C-N 118.827 1.313 . . . . 1.6799999999999999 112.064 -2.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -119.01 134.06 55.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.955 -0.566 . . . . 1.28 110.217 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -91.39 -6.29 53.13 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.099 -0.955 . . . . 3.5099999999999998 109.981 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.406 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.7 p30 -156.15 149.99 25.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.619 -0.719 . . . . 1.52 109.607 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.2 m -61.6 -26.59 68.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.518 -0.765 . . . . 1.1799999999999999 111.45 -177.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.99 -33.2 75.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 2.2400000000000002 111.833 -177.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HG3' HD21 ' A' ' 44' ' ' ASN . 44.5 mt-10 -63.11 -35.33 79.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 2.2599999999999998 110.867 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.8 t -69.68 -35.77 75.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.646 -0.501 . . . . 1.1899999999999999 109.646 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 77.5 mt -66.58 -43.36 90.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.737 -0.665 . . . . 0.55000000000000004 110.108 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 -50.79 72.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.305 -0.861 . . . . 0.56999999999999995 111.148 176.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.77 82.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.5 110.773 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 33' ' ' LEU . 10.8 mt -68.59 -37.56 79.92 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.646 -0.706 . . . . 0.45000000000000001 111.376 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -61.56 -38.96 89.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.003 0.43 . . . . 1.22 110.825 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -69.54 -50.75 41.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 3.0499999999999998 110.811 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.586 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 12.5 mmtt -66.91 -43.81 82.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.8 -0.636 . . . . 1.48 112.32 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.2 m -149.86 97.17 3.47 Favored Pre-proline 0 C--N 1.315 -0.893 0 O-C-N 122.073 -0.392 . . . . 1.1599999999999999 110.485 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -40.82 -56.13 1.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.86 3.04 . . . . 0.57999999999999996 113.276 -171.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.57 -34.54 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.596 -1.184 . . . . 2.4500000000000002 112.208 -177.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 mt -71.71 -40.54 69.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.698 0.761 . . . . 1.4199999999999999 109.156 -176.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.631 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.54 -35.08 91.27 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.35 -1.296 . . . . 0.37 111.526 175.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -69.24 -42.31 75.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.64 0.257 . . . . 0.47999999999999998 110.34 174.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -55.37 -53.28 58.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.967 -0.561 . . . . 2.1699999999999999 110.981 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.1 -30.93 45.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 1.1200000000000001 111.15 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.631 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -62.24 -58.28 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.404 -0.362 . . . . 1.7 110.224 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.586 ' O ' ' HG3' ' A' ' 69' ' ' MET . 85.7 mttt -61.56 -38.79 88.8 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.388 0.614 . . . . 3.96 110.03 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -64.77 -39.47 93.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.062 -0.972 . . . . 1.5 109.82 -179.023 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.53 -29.24 46.34 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.77 -0.65 . . . . 2.3399999999999999 109.292 -175.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.19 -39.82 95.74 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.086 -0.961 . . . . 0.40000000000000002 111.321 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.586 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 20.2 mtm -64.93 -46.94 79.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.429 -0.582 . . . . 0.71999999999999997 109.429 177.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.499 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 94.1 t -56.71 -42.61 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 114.912 -1.04 . . . . 0.79000000000000004 110.289 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -64.17 -38.87 92.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.798 -0.637 . . . . 1.47 110.811 177.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -56.89 -33.3 66.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.196 0.522 . . . . 1.26 110.382 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 69' ' ' MET . 65.4 mmtt -79.38 -49.63 12.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.6 -0.727 . . . . 1.54 110.441 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -69.37 -25.89 30.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.126 0.488 . . . . 0.34000000000000002 111.514 -176.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -36.11 76.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.712 0.767 . . . . 0.34999999999999998 109.698 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.47 2.82 52.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.527 -1.215 . . . . 0.48999999999999999 110.536 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 132' ' ' PHE . 10.9 tp -93.33 134.23 35.75 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.567 -0.742 . . . . 0.70999999999999996 109.321 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.39 153.57 46.07 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.762 -0.732 . . . . 0.76000000000000001 111.838 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -43.07 -38.62 7.49 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.85 3.034 . . . . 1.5600000000000001 113.657 -178.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.06 -54.3 40.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 2.52 110.315 -177.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.408 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -80.84 -28.09 36.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.817 -0.628 . . . . 0.35999999999999999 110.936 -174.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 41.4 ttmt -55.32 -44.37 75.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.626 -0.715 . . . . 2.04 110.278 176.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 87' ' ' LYS . . . -59.98 -42.14 98.19 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.943 -0.646 . . . . 0.40999999999999998 112.02 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -67.2 -43.87 81.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.742 0.306 . . . . 1.6499999999999999 110.985 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -45.38 93.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.372 -0.376 . . . . 0.40999999999999998 111.456 -177.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 33.5 mt-10 -66.42 -23.25 66.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.274 -0.421 . . . . 1.96 111.045 -177.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 83' ' ' GLY . 5.7 mptp? -87.68 -48.48 7.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.365 -0.38 . . . . 2.1200000000000001 111.258 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 10.8 p -61.47 -39.55 91.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.637 0.256 . . . . 0.56999999999999995 111.069 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -59.98 -45.04 95.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 1.0900000000000001 110.866 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.2 -36.4 69.19 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.576 0.227 . . . . 2.8199999999999998 111.323 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 95.0 mt -61.28 -52.2 64.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 0.51000000000000001 110.362 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.16 77.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.64000000000000001 110.801 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -60.61 -42.5 96.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.036 -0.529 . . . . 4.4199999999999999 110.89 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.17 -32.58 84.64 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.008 -0.615 . . . . 0.66000000000000003 111.982 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.8 mm -61.4 -49.27 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.001 0.429 . . . . 0.55000000000000004 110.55 179.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -94.93 21.46 7.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.148 0.499 . . . . 2.7000000000000002 110.576 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -105.23 -34.91 7.74 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.533 -0.758 . . . . 0.63 109.047 168.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.506 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 6.4 ptp180 -80.75 -15.85 55.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.946 -0.57 . . . . 3.1000000000000001 109.61 175.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -65.26 -35.78 82.1 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.135 -0.691 . . . . 0.96999999999999997 109.135 166.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.542 ' CD2' ' HE2' ' A' ' 37' ' ' PHE . 13.4 m-85 -75.27 -46.36 34.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.582 -0.735 . . . . 1.48 112.019 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 41.6 p -60.23 -21.82 62.28 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.865 0.691 . . . . 0.87 112.865 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.16 29.41 5.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.844 -0.693 . . . . 1.1599999999999999 111.957 -174.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -132.77 68.86 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.305 -0.628 . . . . 1.8300000000000001 109.305 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.63 110.68 2.54 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.898 -0.592 . . . . 1.75 111.745 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HG3' ' HG3' ' A' ' 98' ' ' ARG . 78.2 Cg_exo -50.78 148.75 15.53 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.8 3.0 . . . . 0.53000000000000003 113.772 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -88.61 168.76 12.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.788 -0.819 . . . . 1.48 108.788 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.7 tppt? -59.93 -38.39 82.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.403 0.547 . . . . 2.8799999999999999 109.783 -176.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.03 -31.16 72.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.972 -1.013 . . . . 2.2400000000000002 111.258 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -64.15 -44.41 92.2 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.239 0.542 . . . . 1.73 109.837 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.8 mp -68.0 -44.73 75.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.81999999999999995 110.789 177.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 58.4 mtpt -54.66 -46.55 74.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.392 0.615 . . . . 1.74 110.133 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.74 -43.17 94.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.46999999999999997 111.723 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -64.43 -39.17 93.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.977 0.362 . . . . 1.3400000000000001 111.977 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.684 ' O ' HG22 ' A' ' 117' ' ' VAL . 4.3 m -76.74 -27.96 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-O 121.671 0.748 . . . . 0.65000000000000002 109.292 -178.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -62.13 -37.65 85.96 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.9 . . . . 1.72 111.036 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 120' ' ' LEU . 8.7 tt0 -77.35 -34.55 55.11 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 116.453 -0.34 . . . . 2.27 111.147 -175.625 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.684 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -62.02 -34.59 64.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.562 -0.455 . . . . 0.81000000000000005 109.91 171.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.0 mt -72.81 -34.13 66.68 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.281 -0.266 . . . . 1.21 110.281 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -59.85 -42.45 93.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.439 0.638 . . . . 0.94999999999999996 109.344 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.444 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.5 mp -73.58 -45.12 55.16 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.192 -0.913 . . . . 1.0600000000000001 111.288 175.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -72.56 -30.75 64.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.99 -0.684 . . . . 1.54 111.893 -170.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.12 -35.79 81.43 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.006 0.432 . . . . 1.98 110.924 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.98 -4.68 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.896 0.702 . . . . 0.69999999999999996 112.896 -173.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 55.3 mtm -75.0 154.41 38.07 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.425 -0.51 . . . . 0.5 110.902 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.8 m -64.02 140.63 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.269 -0.423 . . . . 1.1799999999999999 110.446 176.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -52.64 -45.75 66.81 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.44 0.533 . . . . 2.21 112.44 -170.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -32.47 70.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.41999999999999998 111.108 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.88 -34.2 53.5 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.484 -0.646 . . . . 0.31 111.484 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -67.37 -44.99 77.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.226 0.536 . . . . 1.3200000000000001 110.371 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.19 -41.66 89.04 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.144 -0.935 . . . . 0.41999999999999998 111.363 178.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -71.6 -26.65 62.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.05 -0.977 . . . . 0.55000000000000004 110.407 -174.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.421 ' HA ' HD11 ' A' ' 77' ' ' LEU . 92.2 t80 -63.01 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.753 -0.658 . . . . 0.39000000000000001 109.898 172.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -74.84 -5.45 74.85 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 121.045 -0.597 . . . . 0.27000000000000002 112.92 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -94.41 -37.38 11.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.398 0.618 . . . . 2.4300000000000002 109.874 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 75.1 mm-40 -90.79 -33.84 15.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.004 -0.998 . . . . 1.8300000000000001 110.922 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.499 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 43.4 m-85 -133.38 72.57 74.85 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 0.68999999999999995 110.471 174.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.93 -29.52 67.08 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.984 2.456 . . . . 0.63 111.774 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -64.58 -39.3 93.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.465 -0.789 . . . . 2.3100000000000001 111.029 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.6 mt -81.93 -40.18 22.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.522 -0.308 . . . . 1.02 110.605 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.66 70.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.115 0.483 . . . . 0.34999999999999998 110.127 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.01 -69.59 0.11 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.373 -0.83 . . . . 2.5800000000000001 111.088 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.581 HG21 HD22 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -60.19 -30.71 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.071 -0.968 . . . . 0.5 112.631 -174.504 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.418 ' CD1' HG22 ' A' ' 142' ' ' VAL . 16.3 m-30 -73.65 -47.08 42.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.149 -0.621 . . . . 0.62 110.726 -175.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -74.51 -30.86 61.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.558 -0.292 . . . . 2.5800000000000001 111.639 -175.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 12.4 p -73.04 -16.35 61.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.09 0.471 . . . . 1.3200000000000001 110.636 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLY . . . . . 0.41 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 93.49 1.45 66.29 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.697 -0.763 . . . . 1.0900000000000001 112.696 176.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.39 -45.67 93.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.616 0.246 . . . . 1.98 110.93 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 142' ' ' VAL . . . -66.17 -39.51 89.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.855 0.359 . . . . 0.34000000000000002 110.132 176.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.66 82.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.51000000000000001 111.485 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 11.7 mptt -75.19 -35.7 61.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 2.8199999999999998 111.117 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 45.6 t80 -67.39 -35.43 79.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.099 0.476 . . . . 0.48999999999999999 109.889 174.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.546 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -72.15 -33.8 68.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.586 -0.733 . . . . 0.58999999999999997 111.216 178.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 89.12 25.57 28.59 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.619 -0.719 . . . . 1.6200000000000001 112.758 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.449 ' CG ' ' H ' ' A' ' 155' ' ' ASN . 3.9 pt-20 -105.62 -111.96 0.27 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.546 0.573 . . . . 4.1200000000000001 112.546 -176.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.449 ' H ' ' CG ' ' A' ' 154' ' ' GLU . 9.0 p30 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 116.003 -0.544 . . . . 4.0099999999999998 111.268 -174.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 19.1 mmt . . . . . 0 N--CA 1.482 1.154 0 CA-C-O 120.708 0.29 . . . . 23.59 110.611 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 123.8 -25.51 6.15 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.72 -0.752 . . . . 22.469999999999999 112.25 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 18.2 p -111.24 30.55 6.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 21.510000000000002 111.242 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 26.9 m -67.04 -47.63 70.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.038 0.446 . . . . 20.190000000000001 109.843 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 15.5 p80 -95.07 136.05 35.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.959 -0.756 . . . . 21.420000000000002 108.959 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 61.97 90.5 0.07 Allowed 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.492 0.495 . . . . 18.199999999999999 110.027 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -47.81 117.07 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.591 -0.732 . . . . 16.059999999999999 111.808 -176.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -135.58 101.55 4.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.472 -0.785 . . . . 13.27 109.372 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -59.46 -43.31 93.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.476 -0.783 . . . . 12.33 111.911 -173.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -80.85 66.27 6.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.832 0.349 . . . . 11.33 110.907 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 5.8 m -137.23 -67.05 0.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 7.9500000000000002 110.373 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 16.6 m -124.26 -172.64 2.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.863 -0.608 . . . . 7.3600000000000003 109.694 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -66.41 98.51 0.39 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.084 -0.579 . . . . 4.5700000000000003 112.639 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -130.26 82.38 2.06 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.626 -0.509 . . . . 4.5199999999999996 109.626 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 75.9 mmm -76.58 130.71 38.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.283 0.563 . . . . 2.0 111.514 -176.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.618 ' CD2' ' HD3' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -62.4 128.9 38.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.881 -1.054 . . . . 1.47 110.895 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . 33.8 mmtp -116.61 146.3 42.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.734 -0.666 . . . . 3.1499999999999999 109.834 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -74.47 -31.36 62.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 2.3500000000000001 109.941 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -75.99 -5.51 46.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.687 -0.688 . . . . 4.1600000000000001 110.439 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 2' ' ' LYS . 20.9 t70 -95.46 -16.51 22.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.002 -0.545 . . . . 2.5699999999999998 109.904 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.499 ' HB ' ' HD2' ' A' ' 11' ' ' ARG . 65.1 mt -70.31 137.72 86.6 Favored Pre-proline 0 C--O 1.236 0.353 0 N-CA-C 108.961 -0.755 . . . . 0.68999999999999995 108.961 175.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -42.24 116.2 0.58 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.463 . . . . 0.59999999999999998 112.111 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.94 -16.75 64.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.56999999999999995 112.045 -173.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.14 -30.39 60.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.835 0.826 . . . . 1.3700000000000001 109.68 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -82.95 -29.37 29.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.55 -1.205 . . . . 0.80000000000000004 110.849 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.499 ' HD2' ' HB ' ' A' ' 6' ' ' ILE . 45.5 mtp180 -70.8 -17.42 62.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.49 0.662 . . . . 1.73 109.952 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -72.14 -22.88 61.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.872 -1.058 . . . . 1.02 110.612 176.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.419 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 85.2 mt -89.35 -12.28 40.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.191 -0.459 . . . . 0.93000000000000005 111.182 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 66.1 mtt -75.82 124.64 88.7 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.428 -0.351 . . . . 1.1499999999999999 110.801 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.504 ' HD3' HD21 ' A' ' 139' ' ' LEU . 54.0 Cg_endo -71.99 153.36 57.86 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.566 2.177 . . . . 0.90000000000000002 111.558 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -45.49 -53.88 5.04 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.593 2.862 . . . . 0.95999999999999996 113.59 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.583 ' O ' HD21 ' A' ' 66' ' ' LEU . 44.0 mt-10 -59.87 -38.12 81.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.749 0.309 . . . . 1.8300000000000001 111.585 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.47 58.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.726 0.298 . . . . 0.81999999999999995 111.1 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 23.0 mtm180 -73.83 -45.03 53.78 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.161 -0.472 . . . . 2.1600000000000001 110.409 177.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -47.65 -44.87 27.39 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.112 0.883 . . . . 1.0600000000000001 111.473 -172.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.405 ' O ' HD23 ' A' ' 25' ' ' LEU . 38.5 t80 -59.94 -67.27 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.022 -0.535 . . . . 0.65000000000000002 111.632 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.545 HD21 ' OH ' ' A' ' 100' ' ' TYR . 24.1 mt -70.61 -11.04 60.68 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.74 1.155 . . . . 1.1299999999999999 112.493 -177.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.65 -40.79 88.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.257 0.551 . . . . 2.0600000000000001 109.769 163.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -74.7 -48.25 26.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.346 -0.843 . . . . 1.8400000000000001 112.041 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 59' ' ' LEU . 4.0 mm? -58.76 140.64 54.66 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.537 0.684 . . . . 1.05 111.852 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.2 p -139.94 -169.47 2.74 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.653 -1.158 . . . . 1.78 109.531 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.17 150.71 33.46 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.765 -0.457 . . . . 2.3900000000000001 109.765 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.51 -53.8 4.38 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.501 -0.857 . . . . 0.93000000000000005 111.322 -174.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 32' ' ' VAL . 16.2 m-20 -66.57 -44.78 81.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.523 0.677 . . . . 2.25 109.525 177.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.618 ' HD3' ' CD2' ' A' ' 1' ' ' PHE . 89.9 mttt -72.07 -12.58 61.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.321 -0.854 . . . . 1.3100000000000001 110.664 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -76.46 -43.43 39.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.892 -0.594 . . . . 0.80000000000000004 109.711 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.36 -29.93 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 115.431 -0.804 . . . . 0.84999999999999998 110.498 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.642 HD23 HD21 ' A' ' 52' ' ' LEU . 23.4 mt -56.18 -42.74 77.58 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.869 0.366 . . . . 0.97999999999999998 110.768 171.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 39.6 ttmt -54.56 -42.1 70.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.903 -0.59 . . . . 2.4100000000000001 110.929 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.942 -0.572 . . . . 1.96 111.548 -176.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.86 -52.26 11.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.513 0.673 . . . . 0.97999999999999998 109.564 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.532 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 47.5 m-85 -58.32 -50.47 73.52 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 115.223 1.564 . . . . 0.82999999999999996 115.223 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 15.5 ptpt -86.54 18.04 3.53 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.42 -0.912 . . . . 2.1800000000000002 111.729 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.46 -78.67 0.59 Allowed 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.509 -0.768 . . . . 1.5600000000000001 109.388 169.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 44.77 -151.37 0.75 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 121.084 -0.579 . . . . 1.54 113.22 -175.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 9.3 Cg_endo -89.28 147.0 22.42 Favored 'Cis proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.986 -1.256 . . . . 1.6799999999999999 111.318 -6.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.431 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 36.0 m-85 -118.02 114.05 22.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.775 -0.648 . . . . 1.28 110.566 -175.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HG3' HD22 ' A' ' 44' ' ' ASN . 13.4 ptmm? -73.19 -7.21 50.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.407 -0.815 . . . . 3.5099999999999998 111.239 177.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.527 HD22 ' HG3' ' A' ' 43' ' ' LYS . 8.4 p30 -150.03 161.97 41.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.902 -0.407 . . . . 1.52 109.902 -178.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 49' ' ' ILE . 19.9 m -73.51 -28.01 61.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.289 -0.414 . . . . 1.1799999999999999 110.86 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 38.2 mt-10 -59.51 -40.98 88.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 2.2400000000000002 111.113 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.431 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.9 mt-10 -62.99 -35.17 79.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.738 0.304 . . . . 2.2599999999999998 111.145 176.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.4 m -69.93 -40.84 75.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.156 0.503 . . . . 1.1899999999999999 110.006 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 45' ' ' THR . 76.2 mt -65.08 -42.72 95.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.55000000000000004 110.212 177.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.31 80.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.298 -0.864 . . . . 0.56999999999999995 111.285 176.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.74 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.433 0.635 . . . . 0.5 110.258 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.642 HD21 HD23 ' A' ' 33' ' ' LEU . 36.4 mt -69.86 -36.35 75.43 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.202 -0.908 . . . . 0.45000000000000001 111.395 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -65.12 -30.24 71.16 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.926 -0.31 . . . . 1.22 111.147 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -75.0 -44.37 48.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.206 0.527 . . . . 3.0499999999999998 110.402 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.46 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 52.3 mmtt -68.71 -55.95 9.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.711 . . . . 1.48 111.607 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 m -142.54 95.7 6.43 Favored Pre-proline 0 C--N 1.315 -0.93 0 N-CA-C 110.214 -0.291 . . . . 1.1599999999999999 110.214 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.34 -59.61 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.96 3.107 . . . . 0.57999999999999996 113.95 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -66.88 -22.07 65.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.49 -0.777 . . . . 2.4500000000000002 112.286 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 3.4 tt -73.85 -41.53 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.602 -1.258 . . . . 1.4199999999999999 107.602 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -64.3 -33.11 86.36 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 114.264 -1.334 . . . . 0.37 111.311 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -65.42 -39.86 92.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.796 0.331 . . . . 0.47999999999999998 110.272 173.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 59' ' ' LEU . 16.5 tppt? -57.0 -57.42 12.64 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.638 -0.71 . . . . 2.1699999999999999 110.916 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 8.1 p -63.48 -35.65 73.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.327 -0.397 . . . . 1.1200000000000001 111.246 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.26 -64.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.228 -0.442 . . . . 1.7 111.458 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HD3' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.55 -32.12 73.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.251 0.548 . . . . 3.96 110.788 -173.016 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.4 tm? -67.29 -46.54 73.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.389 -0.823 . . . . 1.5 110.143 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -24.74 57.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.911 -0.774 . . . . 2.3399999999999999 108.911 -175.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.67 81.94 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.923 -1.035 . . . . 0.40000000000000002 111.804 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.5 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 34.6 mtm -65.08 -50.73 65.0 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.321 -0.622 . . . . 0.71999999999999997 109.321 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.482 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 89.0 t -53.7 -43.62 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 114.795 -1.093 . . . . 0.79000000000000004 110.238 174.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -60.82 -40.17 91.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.311 -0.859 . . . . 1.47 110.683 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.8 m -63.3 -39.31 94.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.641 0.258 . . . . 1.26 111.048 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 69' ' ' MET . 32.9 mmtp -66.64 -43.87 83.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 1.54 110.225 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.487 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 77.9 mt -72.51 -23.44 21.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.242 0.544 . . . . 0.34000000000000002 111.021 178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.14 -30.44 67.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.584 0.707 . . . . 0.34999999999999998 110.184 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.85 2.91 56.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.863 -1.062 . . . . 0.48999999999999999 110.761 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.505 HD13 ' CG ' ' A' ' 135' ' ' GLN . 11.5 tp -95.76 132.67 40.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.715 -0.675 . . . . 0.70999999999999996 110.378 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.86 151.24 49.56 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.894 -0.67 . . . . 0.76000000000000001 112.061 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -41.07 -42.83 4.84 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 124.075 3.183 . . . . 1.5600000000000001 114.312 -176.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -60.53 -51.7 68.32 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.417 0.627 . . . . 2.52 110.305 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.533 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.63 -30.74 32.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.146 -0.934 . . . . 0.35999999999999999 110.646 -173.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 27.7 ttpp -59.3 -44.59 92.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 2.04 110.518 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.68 -41.68 90.23 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.683 -0.77 . . . . 0.40999999999999998 111.436 178.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.12 -48.84 66.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.269 . . . . 1.6499999999999999 111.225 175.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.28 -45.6 76.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.167 0.508 . . . . 0.40999999999999998 111.388 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.647 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 38.8 mt-10 -67.83 -43.37 79.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 1.96 110.419 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -66.35 -44.04 84.39 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.731 0.301 . . . . 2.1200000000000001 111.301 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.2 p -62.77 -41.48 99.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.347 -0.388 . . . . 0.56999999999999995 110.914 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.649 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 28.8 mt -64.59 -39.77 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 116.376 -0.374 . . . . 1.0900000000000001 110.843 177.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.647 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.3 mt-10 -52.97 -44.26 67.02 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.969 0.414 . . . . 2.8199999999999998 110.646 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 48.3 mt -69.55 -44.25 79.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.827 -0.624 . . . . 0.51000000000000001 110.753 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.95 -22.55 64.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.64000000000000001 111.28 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 39.2 mtm180 -63.41 -50.25 70.59 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.803 -0.443 . . . . 4.4199999999999999 109.803 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.96 -35.76 92.41 Favored Glycine 0 N--CA 1.453 -0.219 0 CA-C-N 115.961 -0.563 . . . . 0.66000000000000003 113.185 -172.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.4 -49.44 83.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.991 0.424 . . . . 0.55000000000000004 110.664 -178.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -94.89 7.02 47.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.373 -0.376 . . . . 2.7000000000000002 111.033 -179.095 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -86.24 -30.83 22.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.218 -0.66 . . . . 0.63 109.218 167.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.519 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 61.1 mtp180 -83.24 -7.72 59.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.749 -0.66 . . . . 3.1000000000000001 109.404 174.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.471 ' CE1' ' HD2' ' A' ' 105' ' ' PRO . 8.4 m-85 -80.05 -26.13 39.84 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.084 -0.71 . . . . 0.96999999999999997 109.084 166.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.545 ' OH ' HD21 ' A' ' 22' ' ' LEU . 23.1 m-85 -80.14 -49.26 11.95 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.131 -0.486 . . . . 1.48 110.723 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.534 ' HA ' ' HG3' ' A' ' 34' ' ' LYS . 55.1 p -63.97 -22.33 66.88 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.756 -0.656 . . . . 0.87 112.501 -174.212 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.47 11.1 45.71 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.7 -0.762 . . . . 1.1599999999999999 112.715 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.519 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 58.1 t30 -111.35 66.85 0.63 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.675 -0.491 . . . . 1.8300000000000001 109.675 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.77 123.21 37.66 Favored Pre-proline 0 N--CA 1.464 0.229 0 CA-C-N 115.259 -0.882 . . . . 1.75 112.35 -172.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.471 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 44.9 Cg_endo -69.48 155.04 67.98 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.985 2.457 . . . . 0.53000000000000003 111.995 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.455 ' O ' HD13 ' A' ' 110' ' ' LEU . 80.6 p -83.79 173.92 10.88 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.933 -0.395 . . . . 1.48 109.933 176.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -65.08 -27.67 68.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.236 0.541 . . . . 2.8799999999999999 109.807 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -72.8 -29.58 63.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.877 -0.601 . . . . 2.2400000000000002 110.225 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.71 -44.1 97.58 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-O 121.292 0.567 . . . . 1.73 109.642 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 106' ' ' THR . 7.0 mp -65.18 -45.13 86.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.328 -0.851 . . . . 0.81999999999999995 110.939 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -58.38 -42.02 86.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.173 0.511 . . . . 1.74 110.127 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -63.5 -42.94 98.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.721 -0.672 . . . . 0.46999999999999997 111.412 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.498 ' O ' HG13 ' A' ' 117' ' ' VAL . 77.5 p -63.26 -34.98 78.85 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.771 -0.372 . . . . 1.3400000000000001 111.964 -178.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.611 ' O ' HG22 ' A' ' 117' ' ' VAL . 5.5 m -87.1 -27.3 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.221 0.534 . . . . 0.65000000000000002 110.537 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 14.6 ptpt -71.07 -30.63 66.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.47 . . . . 1.72 110.973 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.61 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.0 mt-10 -77.5 -36.19 52.8 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 119.839 -0.744 . . . . 2.27 110.63 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.41 -28.15 42.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 120.287 -0.565 . . . . 0.81000000000000005 109.68 175.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.482 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.3 mt -73.92 -38.97 64.14 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.637 -0.505 . . . . 1.21 109.637 173.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -58.65 -49.2 78.42 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.438 -0.579 . . . . 0.94999999999999996 109.438 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.4 mm? -61.43 -46.81 88.54 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.662 -0.699 . . . . 1.0600000000000001 112.052 173.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -32.12 64.51 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 118.513 -1.275 . . . . 1.54 111.862 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.079 0.466 . . . . 1.98 110.654 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.2 59.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.698 . . . . 0.69999999999999996 112.577 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.533 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 60.6 mtm -72.71 151.03 42.4 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.662 -0.815 . . . . 0.5 110.042 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.3 p -63.43 150.32 43.9 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 1.1799999999999999 110.145 173.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -55.55 -43.29 75.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.557 0.218 . . . . 2.21 111.501 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.31 -25.15 66.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.137 -0.483 . . . . 0.41999999999999998 111.464 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.46 -36.1 24.34 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.87 -0.681 . . . . 0.31 111.646 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 124' ' ' MET . 98.5 mttt -63.14 -45.92 89.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.211 0.529 . . . . 1.3200000000000001 110.502 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ALA . . . . . 0.529 ' O ' ' HE3' ' A' ' 134' ' ' LYS . . . -66.89 -33.85 76.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.544 -0.753 . . . . 0.41999999999999998 111.335 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -74.79 -32.26 61.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.914 0.388 . . . . 0.55000000000000004 110.049 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.47 -32.36 71.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.968 -0.56 . . . . 0.39000000000000001 110.088 172.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -67.14 -18.65 69.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.889 -0.596 . . . . 0.27000000000000002 113.067 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.529 ' HE3' ' O ' ' A' ' 130' ' ' ALA . 23.2 mmtp -82.8 -29.37 29.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.468 0.651 . . . . 2.4300000000000002 110.065 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.505 ' CG ' HD13 ' A' ' 77' ' ' LEU . 6.2 mm100 -96.23 -40.8 8.99 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.041 -0.981 . . . . 1.8300000000000001 110.976 -174.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.482 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 70.5 m-85 -131.18 74.1 79.74 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.984 0.421 . . . . 0.68999999999999995 109.958 176.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.8 -34.55 72.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.104 2.536 . . . . 0.63 112.621 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 47.8 t80 -64.58 -34.34 78.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.884 0.373 . . . . 2.3100000000000001 110.616 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.512 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 86.6 mt -78.84 -47.43 16.63 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.845 -0.342 . . . . 1.02 110.375 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.03 -33.62 67.38 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.185 0.516 . . . . 0.34999999999999998 109.777 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.553 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.8 tttp -51.09 -73.37 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.89 -1.05 . . . . 2.5800000000000001 111.525 171.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 148' ' ' ALA . 1.1 m -72.17 -13.76 16.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.346 -0.843 . . . . 0.5 112.91 -171.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.2 m-30 -80.21 -44.81 19.1 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.41 -0.516 . . . . 0.62 110.259 175.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.84 -43.05 84.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.861 -0.609 . . . . 2.5800000000000001 110.386 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.4 m -76.85 156.83 31.9 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.96 -0.755 . . . . 1.3200000000000001 108.96 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -79.28 48.74 3.43 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.509 -0.853 . . . . 1.0900000000000001 112.763 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.419 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 1.7 tmtp? -100.64 -65.87 0.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.123 -0.325 . . . . 1.98 110.123 -178.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ALA . . . . . 0.538 ' HB2' HG23 ' A' ' 142' ' ' VAL . . . -64.86 -38.38 90.8 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.061 0.458 . . . . 0.34000000000000002 109.86 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.482 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -55.55 -44.73 77.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.292 -0.867 . . . . 0.51000000000000001 110.763 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.05 -38.14 82.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 2.8199999999999998 110.269 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -58.43 -41.85 85.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 0.48999999999999999 110.255 177.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.584 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.47 -27.99 63.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.741 -0.663 . . . . 0.58999999999999997 111.769 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 110.46 -11.01 30.76 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.314 -0.714 . . . . 1.6200000000000001 111.314 -175.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 149' ' ' ALA . 18.6 mt-10 68.52 146.23 0.05 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 122.072 0.939 . . . . 4.1200000000000001 112.451 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 114.637 -1.165 . . . . 4.0099999999999998 109.824 -179.365 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 87.2 mtp . . . . . 0 N--CA 1.48 1.044 0 CA-C-O 120.732 0.301 . . . . 23.59 110.261 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -113.38 162.14 12.46 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.089 -0.576 . . . . 22.469999999999999 111.89 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 38.7 m -78.41 123.61 27.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.94 0.4 . . . . 21.510000000000002 110.57 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 26.8 p -79.03 110.64 14.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.089 -0.505 . . . . 20.190000000000001 111.054 -177.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -87.79 -22.5 24.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.361 0.6 . . . . 21.420000000000002 109.455 174.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -106.18 104.94 14.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.335 -0.848 . . . . 18.199999999999999 109.349 175.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -97.2 82.79 3.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.548 -0.296 . . . . 16.059999999999999 111.354 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 63.0 t60 -156.7 71.45 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.347 0.594 . . . . 13.27 109.745 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 28.5 t-80 -87.85 -49.03 7.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.66 -0.7 . . . . 12.33 110.923 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -138.84 -60.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.627 -0.429 . . . . 11.33 111.701 -176.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.6 t -134.49 123.53 24.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 7.9500000000000002 111.491 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 34.9 m -88.0 -32.61 18.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.919 -0.582 . . . . 7.3600000000000003 109.657 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 168.07 35.65 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.594 -0.812 . . . . 4.5700000000000003 112.962 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -87.47 151.86 22.69 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.667 -0.494 . . . . 4.5199999999999996 109.667 177.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 8.4 tpt -108.23 138.74 44.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.06 0.457 . . . . 2.0 111.322 -174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -56.38 124.55 18.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.836 -1.075 . . . . 1.47 112.444 -177.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -104.89 135.06 46.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.348 -0.842 . . . . 3.1499999999999999 109.704 176.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.35 -39.93 94.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.08 -0.963 . . . . 2.3500000000000001 112.621 -168.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -93.67 18.59 9.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.18 0.514 . . . . 4.1600000000000001 111.131 -177.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -98.44 0.87 46.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.951 0.881 . . . . 2.5699999999999998 109.092 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.9 mt -81.9 131.93 55.66 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.946 -1.025 . . . . 0.68999999999999995 109.169 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.83 114.79 0.57 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.304 2.67 . . . . 0.59999999999999998 112.349 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.65 66.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.772 -0.649 . . . . 0.56999999999999995 111.481 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -65.21 -34.92 79.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.9 0.857 . . . . 1.3700000000000001 109.697 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 90.7 t80 -82.81 -33.36 27.25 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.447 -1.252 . . . . 0.80000000000000004 110.369 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.543 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 41.1 mtp85 -64.2 -24.86 67.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.324 0.583 . . . . 1.73 110.26 -178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -63.64 -27.02 68.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.02 110.866 176.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 mt -94.23 -19.25 20.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.93000000000000005 110.971 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 91.5 mtp -65.73 131.29 94.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 1.1499999999999999 111.653 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.5 Cg_exo -60.51 137.1 71.71 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.657 2.238 . . . . 0.90000000000000002 111.363 176.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.3 Cg_exo -52.02 -31.24 43.35 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.618 2.878 . . . . 0.95999999999999996 112.916 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -62.56 -49.5 75.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.075 0.464 . . . . 1.8300000000000001 110.541 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.08 65.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 0.81999999999999995 110.909 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -78.56 -44.38 24.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.786 -0.643 . . . . 2.1600000000000001 111.307 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 32.2 t70 -51.71 -49.47 62.42 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.46 0.475 . . . . 1.0600000000000001 112.195 -176.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' HB2' HD22 ' A' ' 66' ' ' LEU . 54.1 t80 -55.93 -58.49 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.378 -0.374 . . . . 0.65000000000000002 111.728 177.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 25' ' ' LEU . 80.1 mt -72.55 -13.11 61.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.894 0.77 . . . . 1.1299999999999999 111.329 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 51.7 tt0 -65.01 -49.47 70.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.688 0.28 . . . . 2.0600000000000001 110.957 167.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -86.84 -30.79 21.2 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.992 0.367 . . . . 1.8400000000000001 111.992 -175.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 22' ' ' LEU . 14.9 tp -67.54 131.25 45.29 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-O 121.328 0.585 . . . . 1.05 110.407 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 14.2 t -119.22 168.6 10.73 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.414 -0.812 . . . . 1.78 110.011 -172.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 0.8 OUTLIER -54.66 -44.4 73.25 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.335 0.865 . . . . 2.3900000000000001 113.335 -169.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.83 -38.33 83.1 Favored Glycine 0 N--CA 1.454 -0.156 0 C-N-CA 120.833 -0.699 . . . . 0.93000000000000005 111.938 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 32' ' ' VAL . 49.7 m-20 -79.61 -38.63 33.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.433 0.159 . . . . 2.25 110.626 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 26' ' ' SER . 82.1 mttt -54.65 -27.95 43.55 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.152 0.501 . . . . 1.3100000000000001 110.237 176.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.404 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 74.7 m -59.36 -36.33 75.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.425 -0.807 . . . . 0.80000000000000004 111.522 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 29' ' ' ASP . 6.1 p -89.22 -24.58 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 116.211 -0.45 . . . . 0.84999999999999998 110.794 -174.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.64 HD13 HD21 ' A' ' 52' ' ' LEU . 4.3 mm? -50.2 -52.01 39.28 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.345 -0.389 . . . . 0.97999999999999998 111.318 173.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 46.2 pttt -66.19 -21.22 66.31 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.107 0.41 . . . . 2.4100000000000001 112.107 -176.253 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -70.71 -27.99 64.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.159 0.504 . . . . 1.96 110.184 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.96 -51.89 16.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.726 . . . . 0.97999999999999998 109.967 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.54 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 49.7 m-85 -60.71 -45.76 92.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.899 1.444 . . . . 0.82999999999999996 114.899 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.9 -20.95 60.24 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.012 -0.675 . . . . 2.1800000000000002 110.504 -177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.23 -76.6 0.13 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.903 -0.59 . . . . 1.5600000000000001 109.907 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.405 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 48.32 -158.38 0.83 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.077 -0.582 . . . . 1.54 112.693 -176.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -95.03 138.01 5.9 Favored 'Cis proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.184 -1.173 . . . . 1.6799999999999999 111.175 -9.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 41.7 m-85 -114.27 108.18 16.59 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.56 0.695 . . . . 1.28 110.916 -173.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.45 -8.93 29.33 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.435 -1.257 . . . . 3.5099999999999998 111.0 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -137.79 163.54 31.11 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.617 -0.883 . . . . 1.52 108.617 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.9 m -85.33 -33.29 22.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.797 0.332 . . . . 1.1799999999999999 110.379 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.449 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.1 mp0 -56.61 -34.28 67.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 2.2400000000000002 111.702 179.343 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.6 OUTLIER -68.57 -38.07 80.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.74 0.305 . . . . 2.2599999999999998 111.242 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.5 m -66.52 -39.34 88.57 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.507 -0.553 . . . . 1.1899999999999999 109.507 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 64' ' ' GLU . 97.0 mt -61.79 -44.66 99.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.254 -0.885 . . . . 0.55000000000000004 110.108 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.77 -48.69 80.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.56999999999999995 111.861 176.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.48 87.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.304 0.573 . . . . 0.5 110.214 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.64 HD21 HD13 ' A' ' 33' ' ' LEU . 29.0 mt -66.49 -38.06 86.44 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.184 -0.916 . . . . 0.45000000000000001 111.331 178.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.27 -39.44 92.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.838 0.351 . . . . 1.22 111.547 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -71.24 -44.62 64.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.41 -0.359 . . . . 3.0499999999999998 111.123 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HB3' HG21 ' A' ' 32' ' ' VAL . 25.3 mmtt -68.73 -48.79 62.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.125 -0.489 . . . . 1.48 111.931 177.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.2 m -145.4 96.9 4.78 Favored Pre-proline 0 C--N 1.313 -1.004 0 O-C-N 122.234 -0.291 . . . . 1.1599999999999999 110.502 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -41.8 -56.79 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.809 3.006 . . . . 0.57999999999999996 113.209 -170.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.475 ' HG2' ' HE3' ' A' ' 62' ' ' LYS . 37.0 tt0 -60.21 -35.41 75.36 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.533 -1.212 . . . . 2.4500000000000002 112.436 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 29' ' ' ASP . 62.1 mt -69.6 -40.61 76.56 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 119.406 -0.917 . . . . 1.4199999999999999 109.05 -175.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.73 -38.43 96.18 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 114.311 -1.313 . . . . 0.37 111.691 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.9 95.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.745 0.307 . . . . 0.47999999999999998 110.49 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HE3' ' HG2' ' A' ' 58' ' ' GLU . 98.7 mttt -62.45 -58.73 6.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.013 -0.539 . . . . 2.1699999999999999 110.913 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 11.5 p -62.88 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 1.1200000000000001 111.425 -177.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.525 ' HA ' HD13 ' A' ' 49' ' ' ILE . 38.3 tt0 -67.0 -57.73 6.3 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 121.011 -0.276 . . . . 1.7 111.016 178.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' MET . 0.1 OUTLIER -64.67 -31.19 72.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.619 0.723 . . . . 3.96 109.706 -175.468 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.562 HD22 ' HB2' ' A' ' 21' ' ' PHE . 21.5 tp -67.79 -38.15 82.95 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.707 -1.133 . . . . 1.5 110.49 177.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -79.36 -31.65 43.02 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.974 -0.75 . . . . 2.3399999999999999 108.974 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.42 95.45 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.851 -1.068 . . . . 0.40000000000000002 111.138 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 43.9 mtm -58.79 -55.72 31.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.892 -0.41 . . . . 0.71999999999999997 109.892 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 66' ' ' LEU . 95.2 t -50.93 -46.82 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 115.366 -0.834 . . . . 0.79000000000000004 110.949 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 12.8 mtpt -66.17 -33.92 76.86 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.662 -0.699 . . . . 1.47 112.308 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.4 t -56.6 -41.56 77.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.086 0.47 . . . . 1.26 110.649 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 3.9 mptp? -69.6 -45.33 68.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.963 -0.562 . . . . 1.54 110.061 177.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -67.94 -25.27 31.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.221 0.534 . . . . 0.34000000000000002 110.889 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.27 -33.77 73.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.709 0.766 . . . . 0.34999999999999998 109.939 173.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.01 -1.94 58.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.741 -1.118 . . . . 0.48999999999999999 110.83 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.9 tp -93.95 137.97 32.58 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.731 -0.668 . . . . 0.70999999999999996 109.894 -175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.97 149.28 51.46 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.393 -0.67 . . . . 0.76000000000000001 112.037 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -37.95 -42.85 1.48 Allowed 'Trans proline' 0 N--CA 1.478 0.603 0 C-N-CA 124.666 3.577 . . . . 1.5600000000000001 114.741 -176.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -70.14 -51.37 31.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.552 0.215 . . . . 2.52 110.683 -177.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.49 -33.46 69.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.711 0.767 . . . . 0.35999999999999999 109.825 -177.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -57.2 -45.92 83.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.401 -1.272 . . . . 2.04 110.927 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.24 97.93 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.654 -0.784 . . . . 0.40999999999999998 111.738 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.526 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 6.5 t80 -62.49 -48.02 81.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.359 -0.237 . . . . 1.6499999999999999 110.359 175.503 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.691 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -56.83 -56.95 14.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.274 . . . . 0.40999999999999998 111.385 -178.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 30.3 mt-10 -62.7 -25.13 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 1.96 111.408 -174.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.451 ' O ' HG13 ' A' ' 91' ' ' ILE . 53.5 tttp -86.75 -41.46 14.11 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.641 -0.254 . . . . 2.1200000000000001 111.05 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.8 p -66.75 -39.47 87.92 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.683 -0.235 . . . . 0.56999999999999995 111.158 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 85' ' ' ALA . 51.7 mm -58.12 -40.14 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 110.077 -0.342 . . . . 1.0900000000000001 110.077 176.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 75.5 mm-40 -63.61 -34.49 77.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.11 -0.495 . . . . 2.8199999999999998 111.246 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 87' ' ' LYS . 53.2 mt -65.82 -49.6 76.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.777 0.323 . . . . 0.51000000000000001 110.482 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.92 -36.01 79.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.683 -0.488 . . . . 0.64000000000000001 109.683 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -56.91 -40.62 76.62 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.468 -0.787 . . . . 4.4199999999999999 110.763 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.86 -36.47 82.03 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.899 -0.667 . . . . 0.66000000000000003 112.46 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 110' ' ' LEU . 45.4 mm -67.62 -49.59 68.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.256 0.551 . . . . 0.55000000000000004 110.071 178.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.7 ptmm? -80.68 2.37 26.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 2.7000000000000002 111.131 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.66 -26.37 27.83 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.89 -0.782 . . . . 0.63 108.89 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.1 mtp180 -86.86 -1.56 57.89 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 3.1000000000000001 109.866 174.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -90.84 -22.11 21.13 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.909 -0.404 . . . . 0.96999999999999997 109.909 165.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.564 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 30.8 m-85 -84.82 -45.04 12.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.96 0.409 . . . . 1.48 110.731 176.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.57 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 16.7 p -70.17 -20.97 63.1 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.005 0.743 . . . . 0.87 113.005 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 98.28 1.47 58.07 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.762 -0.733 . . . . 1.1599999999999999 112.789 -174.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.625 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 21.5 m120 -92.64 56.97 2.8 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 122.706 -0.29 . . . . 1.8300000000000001 110.732 -178.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -43.72 123.21 3.81 Favored Pre-proline 0 N--CA 1.469 0.476 0 O-C-N 124.128 0.893 . . . . 1.75 112.374 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.0 155.52 38.4 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.946 2.431 . . . . 0.53000000000000003 112.177 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -94.17 177.95 5.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.96 -0.756 . . . . 1.48 108.96 173.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.0 ptpp? -62.77 -31.14 72.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.036 -0.666 . . . . 2.8799999999999999 110.86 -175.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -61.81 -38.28 87.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.605 -0.271 . . . . 2.2400000000000002 110.777 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -63.54 -45.0 92.55 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.28 0.562 . . . . 1.73 110.3 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 95' ' ' ILE . 40.4 mt -67.24 -41.93 84.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.296 -0.865 . . . . 0.81999999999999995 110.895 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 59.1 mtpt -60.98 -41.75 97.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.973 0.416 . . . . 1.74 110.021 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.55 -39.44 93.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.939 -0.573 . . . . 0.46999999999999997 111.291 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 117' ' ' VAL . 73.7 p -66.28 -33.6 76.11 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.392 0.515 . . . . 1.3400000000000001 112.392 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.58 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.2 m -85.85 -25.81 6.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.868 0.842 . . . . 0.65000000000000002 109.404 -179.033 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 10.3 ttpt -61.5 -46.11 91.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.589 -1.187 . . . . 1.72 111.405 -178.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.491 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.1 mt-10 -73.01 -33.88 66.03 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.666 -0.414 . . . . 2.27 111.793 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.5 m -64.13 -34.67 70.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.235 -0.586 . . . . 0.81000000000000005 110.457 178.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' CD2' ' HB2' ' A' ' 149' ' ' ALA . 5.0 mp -76.79 -30.01 56.26 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.281 -0.568 . . . . 1.21 110.471 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -62.07 -38.21 87.92 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.168 -0.679 . . . . 0.94999999999999996 109.168 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.1 mp -76.74 -47.5 21.61 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.234 -0.894 . . . . 1.0600000000000001 111.925 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.526 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 12.9 t80 -72.76 -39.48 66.76 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.469 -0.493 . . . . 1.54 111.938 -168.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -65.42 -36.66 84.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.368 0.604 . . . . 1.98 110.142 178.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.57 -2.1 24.43 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.7 -1.136 . . . . 0.69999999999999996 112.99 -176.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 74.0 mtm -78.63 153.05 31.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.494 -0.928 . . . . 0.5 108.494 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -53.43 -79.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.402 0.546 . . . . 1.1799999999999999 111.083 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.502 ' HA ' ' HG2' ' A' ' 129' ' ' LYS . 24.0 t70 -168.78 -47.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.358 -0.214 . . . . 2.21 110.956 175.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.56 74.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.264 -0.425 . . . . 0.41999999999999998 110.855 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.18 -40.75 28.45 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.444 -0.798 . . . . 0.31 112.685 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 126' ' ' ASP . 4.5 ptpp? -70.81 -35.96 72.76 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.345 -0.542 . . . . 1.3200000000000001 110.528 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.94 -23.43 60.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.41999999999999998 110.699 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASP . . . . . 0.469 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 35.6 t70 -78.86 -32.33 45.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.55000000000000004 109.653 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.39 -28.26 69.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.491 -0.777 . . . . 0.39000000000000001 109.855 173.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.39 -16.73 69.68 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.27000000000000002 113.211 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 64.8 mttt -86.34 -40.31 15.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 121.628 0.728 . . . . 2.4300000000000002 109.643 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 1.8 mp0 -78.44 -43.45 27.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.753 -1.112 . . . . 1.8300000000000001 111.281 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' PHE . . . . . 0.444 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 65.7 m-85 -128.1 77.32 76.89 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.68999999999999995 110.025 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.36 -36.5 44.71 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.319 2.68 . . . . 0.63 113.333 -172.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' PHE . . . . . 0.576 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 52.3 t80 -62.41 -40.77 97.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 2.3100000000000001 111.373 -175.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 143' ' ' PHE . 92.2 mt -75.2 -45.6 39.41 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.855 -0.338 . . . . 1.02 110.651 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.88 71.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.34999999999999998 110.291 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.9 tttt -52.42 -72.08 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 2.5800000000000001 111.175 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.575 ' HB ' ' CB ' ' A' ' 147' ' ' LYS . 2.4 m -64.56 -31.71 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.195 -0.911 . . . . 0.5 113.004 -171.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 139' ' ' LEU . 21.3 m-30 -63.88 -29.05 70.27 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.983 0.421 . . . . 0.62 110.92 -177.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -91.19 -12.19 36.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.499 . . . . 2.5800000000000001 111.558 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 26.4 t -118.24 46.88 1.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.19 0.519 . . . . 1.3200000000000001 110.098 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 69.68 -99.6 0.68 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.9 -0.667 . . . . 1.0900000000000001 111.607 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' LYS . . . . . 0.575 ' CB ' ' HB ' ' A' ' 142' ' ' VAL . 31.2 mmtm 48.12 -95.54 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 113.064 0.764 . . . . 1.98 113.064 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.24 90.38 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.054 0.454 . . . . 0.34000000000000002 110.395 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 118' ' ' LEU . . . -64.1 -43.14 96.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.51000000000000001 110.295 176.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -66.26 -35.87 81.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.241 0.543 . . . . 2.8199999999999998 110.176 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 56.6 t80 -62.29 -38.11 88.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.345 -0.843 . . . . 0.48999999999999999 110.722 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.425 ' HB2' ' CG2' ' A' ' 114' ' ' VAL . . . -94.01 6.25 49.11 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.734 -0.666 . . . . 0.58999999999999997 111.985 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 97.15 -66.12 0.91 Allowed Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 109.945 -1.262 . . . . 1.6200000000000001 109.945 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLU . . . . . 0.611 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 15.5 tt0 179.94 -171.83 0.18 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.509 -1.293 . . . . 4.1200000000000001 107.509 171.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.611 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 7.6 t30 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.271 -0.871 . . . . 4.0099999999999998 109.974 -177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.539 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 18.4 t80 . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 121.52 0.676 . . . . 1.47 112.221 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -123.27 124.18 42.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.662 -0.699 . . . . 3.15 109.343 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.412 ' CD1' HD12 ' A' ' 6' ' ' ILE . 56.8 t80 -67.77 -17.61 64.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.276 0.56 . . . . 2.35 110.513 -175.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -82.59 -9.02 59.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.404 -0.816 . . . . 4.16 110.337 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -97.87 -7.63 29.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.074 -0.512 . . . . 2.57 110.799 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.412 HD12 ' CD1' ' A' ' 3' ' ' TYR . 52.5 mt -75.47 135.88 71.95 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.295 -0.632 . . . . 0.69 109.295 177.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.96 112.11 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.658 2.239 . . . . 0.6 111.508 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.4 -22.21 66.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.57 112.005 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.76 -30.88 71.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 122.023 0.916 . . . . 1.37 109.533 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -88.81 -26.25 21.79 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.037 -1.438 . . . . 0.8 110.736 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -72.96 -19.58 61.21 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.681 0.753 . . . . 1.73 109.5 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -72.03 -23.74 61.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.694 -1.139 . . . . 1.02 110.421 172.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.534 HD21 ' CD ' ' A' ' 147' ' ' LYS . 86.8 mt -94.5 17.69 12.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.852 -0.613 . . . . 0.93 112.046 -175.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.454 ' SD ' ' HG2' ' A' ' 19' ' ' ARG . 19.4 ptp -128.08 145.16 54.29 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 120.795 -0.362 . . . . 1.15 110.046 177.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 31.9 Cg_exo -59.65 140.33 93.11 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.986 2.457 . . . . 0.9 112.316 -176.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.88 -34.18 90.84 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.964 3.11 . . . . 0.96 112.692 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.56 -39.38 93.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.619 -0.718 . . . . 1.83 110.366 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.22 -4.41 50.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.82 110.755 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 31.7 mtm180 -98.45 -38.77 9.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.986 -0.552 . . . . 2.16 110.162 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -48.78 -42.74 36.74 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.899 0.75 . . . . 1.06 111.275 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -56.76 -54.84 41.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.533 -0.758 . . . . 0.65 112.132 175.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.588 HD21 ' OH ' ' A' ' 100' ' ' TYR . 65.5 mt -79.53 -10.71 59.85 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.203 0.91 . . . . 1.13 111.266 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.26 -45.72 75.83 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.125 0.488 . . . . 2.06 110.795 162.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -88.81 -26.48 21.67 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.752 0.649 . . . . 1.84 112.752 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.518 HD23 ' CD2' ' A' ' 22' ' ' LEU . 4.8 tp -77.11 136.59 38.63 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-O 121.209 0.528 . . . . 1.05 110.431 -174.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 4.9 p -120.55 -179.18 3.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.525 -0.761 . . . . 1.78 111.738 -171.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.45 -52.17 48.62 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 2.39 112.955 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.87 -42.05 78.21 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 116.226 -0.443 . . . . 0.93 113.31 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.669 ' O ' HG12 ' A' ' 32' ' ' VAL . 20.8 m-20 -80.86 -36.16 31.75 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.795 -0.238 . . . . 2.25 111.169 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' HD23 ' A' ' 33' ' ' LEU . 96.8 mttt -55.86 -34.03 65.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.325 0.583 . . . . 1.31 110.448 177.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.7 m -55.53 -36.56 66.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.01 -0.996 . . . . 0.8 112.145 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -88.34 -21.47 6.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 111.978 0.362 . . . . 0.85 111.978 -171.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -52.99 -48.06 67.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.681 0.277 . . . . 0.98 111.193 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -64.22 -27.68 69.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.338 -0.392 . . . . 2.41 111.184 -175.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -68.52 -37.21 79.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.047 0.451 . . . . 1.96 110.052 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 93.4 t -72.62 -48.97 44.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.71 -0.677 . . . . 0.98 110.104 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.618 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 32.3 m-85 -57.0 -52.67 64.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.462 1.282 . . . . 0.83 114.462 176.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.63 -20.4 59.92 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.286 -0.566 . . . . 2.18 111.574 -171.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.64 -74.93 0.21 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.484 -0.325 . . . . 1.56 110.255 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.473 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.89 -157.16 1.19 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 121.017 -0.611 . . . . 1.54 112.968 -176.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -95.95 153.58 10.61 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 CA-C-N 118.536 1.168 . . . . 1.68 112.001 -7.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 27.7 m-85 -122.3 120.69 34.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 1.28 111.137 -171.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.61 -8.16 54.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.149 -0.932 . . . . 3.51 110.554 175.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -160.19 163.81 33.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.018 -0.734 . . . . 1.52 109.018 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.3 m -77.8 -22.77 49.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.776 -0.193 . . . . 1.18 111.509 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.83 -36.0 77.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 2.24 110.421 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 14.6 mm-40 -57.71 -40.85 80.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.136 0.493 . . . . 2.26 110.787 173.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.3 t -70.97 -36.05 72.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.772 -0.649 . . . . 1.19 109.846 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.76 -44.87 98.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.286 0.565 . . . . 0.55 109.745 176.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.56 -48.7 80.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.021 -0.991 . . . . 0.57 111.159 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.55 -40.65 87.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.324 0.583 . . . . 0.5 110.273 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 33' ' ' LEU . 36.5 mt -67.65 -38.24 83.52 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.307 -0.861 . . . . 0.45 111.057 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -31.11 72.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.086 0.469 . . . . 1.22 110.995 177.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -75.15 -46.8 31.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 3.05 110.946 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -82.79 -37.41 24.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.178 -0.465 . . . . 1.48 112.237 -175.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.7 t -144.49 87.95 7.42 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 109.472 -0.566 . . . . 1.16 109.472 176.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -41.42 -60.55 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 124.201 3.268 . . . . 0.58 113.9 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.55 -34.53 74.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.117 -0.947 . . . . 2.45 111.969 -178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.423 HD22 ' HB3' ' A' ' 29' ' ' ASP . 39.2 tp -68.94 -36.81 78.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.061 -0.718 . . . . 1.42 109.061 -175.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.51 -35.34 91.92 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 114.664 -1.153 . . . . 0.37 111.668 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.99 -35.8 69.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.116 0.484 . . . . 0.48 110.384 175.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -64.2 -44.26 92.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 2.17 111.08 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.5 m -74.71 -30.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.944 -0.302 . . . . 1.12 110.765 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.67 -58.89 6.6 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.256 -0.429 . . . . 1.7 110.77 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 69' ' ' MET . 82.7 tttt -57.49 -37.49 73.02 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.476 0.655 . . . . 3.96 110.254 -176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.4 tm? -65.89 -45.69 81.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.02 -0.991 . . . . 1.5 109.958 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -78.3 -30.75 48.52 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.113 -0.699 . . . . 2.34 109.113 -172.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.78 -45.51 94.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.155 -0.929 . . . . 0.4 111.534 176.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.512 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 53.1 mtm -59.61 -48.36 81.95 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.381 0.61 . . . . 0.72 109.873 176.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' LEU . 96.4 t -54.88 -45.53 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 114.915 -1.039 . . . . 0.79 110.611 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -63.61 -38.12 89.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 1.47 111.663 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.0 m -61.03 -37.48 82.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.082 0.468 . . . . 1.26 110.791 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.0 mttm -73.47 -48.17 35.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.833 -0.621 . . . . 1.54 110.003 176.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.52 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 81.1 mt -62.08 -20.62 24.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.665 0.745 . . . . 0.34 110.678 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.41 -27.81 61.66 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.394 -0.821 . . . . 0.35 109.793 177.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.35 0.79 57.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.402 -1.272 . . . . 0.49 110.279 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 77' ' ' LEU . 7.6 tp -96.02 140.34 30.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.726 -0.67 . . . . 0.71 110.634 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.86 160.21 53.18 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.998 -0.62 . . . . 0.76 112.158 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -48.04 -42.96 31.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.929 3.086 . . . . 1.56 113.657 -174.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.13 -45.19 74.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.601 -0.272 . . . . 2.52 110.966 -177.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.87 -30.83 40.35 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.002 -0.679 . . . . 0.36 110.297 -176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 41.1 ttmt -62.78 -40.72 98.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.625 -0.716 . . . . 2.04 110.704 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.5 -36.93 93.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.878 -0.677 . . . . 0.41 111.869 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -68.55 -46.5 69.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.192 . . . . 1.65 110.545 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.78 -55.24 36.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.74 0.305 . . . . 0.41 111.547 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -84.26 39.46 0.72 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 1.96 110.691 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.547 ' O ' HG13 ' A' ' 91' ' ' ILE . 61.1 tttp -149.51 -43.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.681 -0.69 . . . . 2.12 109.285 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.7 p -67.31 -44.2 79.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.335 -0.393 . . . . 0.57 110.156 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 61.0 mt -64.06 -32.97 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-N 116.109 -0.496 . . . . 1.09 110.183 176.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -60.79 -35.72 77.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.968 0.413 . . . . 2.82 110.069 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 87' ' ' LYS . 54.1 mt -72.22 -50.59 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.51 110.027 176.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.84 99.77 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.862 -0.608 . . . . 0.64 111.484 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.03 -37.08 84.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.749 -0.659 . . . . 4.42 110.006 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.38 -31.9 81.01 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 121.096 -0.573 . . . . 0.66 111.916 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.8 mm -62.99 -53.54 45.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 0.55 110.667 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HD2' HD11 ' A' ' 22' ' ' LEU . 55.7 pttt -84.36 3.44 35.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.204 -0.453 . . . . 2.7 110.904 -178.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.618 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -91.5 -34.56 14.74 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.779 -0.452 . . . . 0.63 109.779 170.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 7.3 ptp180 -83.68 -3.59 57.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.261 -0.644 . . . . 3.1 109.261 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.2 m-85 -79.33 -34.42 42.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.709 -0.478 . . . . 0.97 109.709 164.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.593 ' HD2' ' CE2' ' A' ' 37' ' ' PHE . 22.9 m-85 -67.62 -44.92 76.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.373 0.606 . . . . 1.48 110.642 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.6 p -66.22 -21.93 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.078 -0.964 . . . . 0.87 112.675 -174.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.75 1.03 56.36 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.871 -0.681 . . . . 1.16 112.067 -174.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -93.6 56.88 2.46 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.878 0.37 . . . . 1.83 110.02 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -55.7 119.36 24.76 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.495 -0.775 . . . . 1.75 111.98 -172.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.498 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 36.8 Cg_endo -67.38 146.81 76.28 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.409 2.739 . . . . 0.53 112.543 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -77.32 168.27 20.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.777 -0.453 . . . . 1.48 109.777 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -56.77 -32.65 65.84 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.473 0.654 . . . . 2.88 111.163 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -83.28 -14.57 52.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.561 -0.745 . . . . 2.24 111.468 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 105' ' ' PRO . 12.2 t70 -68.04 -40.96 82.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.608 -0.515 . . . . 1.73 109.608 174.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -30.75 71.77 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.554 -0.748 . . . . 0.82 110.985 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -59.75 -46.55 88.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.607 -0.516 . . . . 1.74 109.607 176.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.067 -0.97 . . . . 0.47 110.821 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.454 ' OG ' HG22 ' A' ' 91' ' ' ILE . 33.5 t -53.38 -60.54 3.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 1.34 111.478 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.813 HG23 ' HB2' ' A' ' 152' ' ' ALA . 16.2 m -76.19 -24.02 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.014 0.435 . . . . 0.65 110.824 -172.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -54.94 -45.57 74.86 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.865 -0.607 . . . . 1.72 110.758 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.509 ' O ' HD13 ' A' ' 120' ' ' LEU . 31.7 mt-10 -75.03 -31.99 61.48 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.313 -0.555 . . . . 2.27 111.108 -178.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.3 m -65.29 -32.67 59.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 119.647 -0.821 . . . . 0.81 109.92 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 149' ' ' ALA . 83.0 mt -75.35 -36.4 61.0 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.416 . . . . 1.21 109.878 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -60.13 -38.09 82.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.467 0.651 . . . . 0.95 109.486 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.509 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -78.7 -44.51 23.41 Favored 'General case' 0 N--CA 1.438 -1.025 0 CA-C-N 115.136 -0.938 . . . . 1.06 112.073 174.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -72.91 -32.44 65.33 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 119.476 -0.89 . . . . 1.54 111.759 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -66.78 -32.73 74.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.084 0.469 . . . . 1.98 110.632 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.85 -9.52 59.28 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.775 0.657 . . . . 0.7 112.775 -174.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.0 mtm -75.07 154.7 37.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.317 -0.553 . . . . 0.5 110.608 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.3 m -64.4 143.72 57.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.11 -0.33 . . . . 1.18 110.11 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.68 -45.93 63.63 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.317 0.488 . . . . 2.21 112.317 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.97 -33.34 73.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.89 0.376 . . . . 0.42 111.032 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -75.03 -35.24 50.33 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.536 -0.626 . . . . 0.31 111.536 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.65 -43.13 94.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.197 0.522 . . . . 1.32 109.617 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.57 -29.86 66.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.53 -0.759 . . . . 0.42 111.467 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -75.19 -30.62 60.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.071 0.462 . . . . 0.55 109.803 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.413 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.8 t80 -61.65 -27.21 68.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.604 . . . . 0.39 110.162 172.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.82 -3.35 73.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.942 -0.646 . . . . 0.27 113.052 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -96.54 -39.94 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.481 0.657 . . . . 2.43 109.915 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -86.39 -32.42 20.94 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.884 -1.053 . . . . 1.83 110.634 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.458 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 53.1 m-85 -136.24 73.1 58.23 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.994 0.426 . . . . 0.69 110.951 174.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.99 -36.72 81.41 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.287 2.658 . . . . 0.63 112.942 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 38.2 t80 -61.71 -40.08 93.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.508 -0.314 . . . . 2.31 110.878 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -77.37 -43.22 33.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 1.02 110.604 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.07 -40.07 73.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 0.35 109.947 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' A' ' 141' ' ' LYS . 0.0 OUTLIER -44.95 -68.06 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.955 -1.02 . . . . 2.58 111.613 173.449 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.508 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.0 OUTLIER -65.0 -22.77 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.229 -0.896 . . . . 0.5 112.132 -174.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -78.99 -38.92 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.191 -0.604 . . . . 0.62 110.739 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 49.6 mt-10 -71.09 -43.85 66.88 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.908 0.385 . . . . 2.58 110.316 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.0 m -69.78 -20.0 63.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.742 -0.663 . . . . 1.32 111.059 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 86.07 15.34 65.09 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.767 -0.73 . . . . 1.09 112.583 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.534 ' CD ' HD21 ' A' ' 13' ' ' LEU . 0.7 OUTLIER -63.02 -42.92 99.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.491 -0.559 . . . . 1.98 109.491 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -69.93 -32.75 71.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.34 110.298 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.505 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -60.84 -41.67 96.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.839 -0.618 . . . . 0.51 111.052 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -71.38 -8.97 57.26 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.842 0.353 . . . . 2.82 111.512 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -93.99 -40.53 10.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.945 0.402 . . . . 0.49 109.953 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.813 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.18 -24.59 51.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.823 -0.626 . . . . 0.59 112.362 -178.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.714 0 N-CA-C 110.012 -1.235 . . . . 1.62 110.012 -169.478 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.3 p90 . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.364 0.602 . . . . 1.47 111.705 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 71.8 mmtt -111.14 171.88 7.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.712 -0.676 . . . . 3.15 109.369 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 75.7 t80 -61.81 -50.44 72.28 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.153 0.502 . . . . 2.35 109.971 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.41 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 9.5 pt-20 -74.3 -6.43 47.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 4.16 111.883 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.424 ' CB ' ' H ' ' A' ' 2' ' ' LYS . 11.7 t70 -78.88 -29.61 44.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.294 -0.632 . . . . 2.57 109.294 -177.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.8 mt -69.31 135.6 88.9 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.625 -0.716 . . . . 0.69 109.093 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -45.46 119.72 2.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.259 2.639 . . . . 0.6 112.28 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.24 -18.66 65.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.57 112.123 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.68 -33.72 75.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.984 0.897 . . . . 1.37 109.251 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -82.61 -29.32 30.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 113.99 -1.459 . . . . 0.8 111.26 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 18.5 mtm180 -71.98 -18.08 62.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.455 0.645 . . . . 1.73 109.483 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.61 -27.24 63.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.727 -1.124 . . . . 1.02 110.634 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.479 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 71.8 mt -77.26 -51.54 10.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.976 -0.557 . . . . 0.93 111.385 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.447 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 25.3 ptt? -75.3 136.9 71.83 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 1.15 111.515 -174.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 31.7 Cg_exo -59.68 159.8 23.16 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.534 2.823 . . . . 0.9 112.957 -177.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -53.34 -31.41 56.87 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.55 2.833 . . . . 0.96 112.952 -178.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.518 ' O ' HD21 ' A' ' 66' ' ' LEU . 43.8 mt-10 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.816 0.341 . . . . 1.83 110.564 177.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -21.32 66.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.319 -0.401 . . . . 0.82 111.187 -178.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 11' ' ' ARG . 20.0 mtm180 -88.39 -31.18 18.98 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.955 -0.566 . . . . 2.16 110.715 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -52.15 -51.23 59.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.99 -0.55 . . . . 1.06 111.262 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.564 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.6 t80 -55.41 -61.56 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.65 111.627 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 59.9 mt -74.46 -9.19 58.35 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 119.108 0.867 . . . . 1.13 111.944 -176.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.35 -40.24 77.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.192 0.52 . . . . 2.06 109.989 163.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.88 -47.11 40.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.446 -0.797 . . . . 1.84 111.074 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.612 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.9 mm? -59.85 141.54 55.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.4 0.619 . . . . 1.05 111.202 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.6 t -116.14 -63.76 1.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.78 110.314 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -176.02 -47.83 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.134 0.271 . . . . 2.39 111.432 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.61 -34.64 79.1 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.519 -0.848 . . . . 0.93 111.305 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -36.93 69.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 2.25 109.946 173.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.449 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 88.5 mttt -61.64 -26.88 68.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.329 -0.85 . . . . 1.31 111.61 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 21.7 m -64.64 -35.67 81.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 0.8 110.35 177.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.6 t -66.27 -41.03 88.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.85 110.715 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.582 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.4 mm? -56.77 -46.27 81.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.915 0.388 . . . . 0.98 110.417 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -55.88 -43.21 76.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 2.41 111.681 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 31' ' ' THR . 40.4 mm-40 -69.86 -33.2 71.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 1.96 111.407 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 67.6 t -75.59 -51.27 21.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.98 110.8 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.427 ' HB3' ' CG2' ' A' ' 101' ' ' THR . 14.6 m-85 -48.14 -50.61 28.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.791 1.034 . . . . 0.83 113.791 174.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -73.73 -25.55 60.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.115 -0.634 . . . . 2.18 111.571 -175.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.56 -79.16 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.17 -0.308 . . . . 1.56 110.17 174.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.538 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.43 -148.23 3.41 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.749 -0.739 . . . . 1.54 112.395 -173.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.458 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.5 149.82 12.9 Favored 'Cis proline' 0 N--CA 1.454 -0.813 0 CA-C-N 118.734 1.267 . . . . 1.68 111.116 -8.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.538 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 18.0 m-85 -118.44 128.12 54.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.485 0.659 . . . . 1.28 111.62 -170.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -86.89 -15.15 39.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.67 -1.15 . . . . 3.51 108.314 175.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 47' ' ' GLU . 7.3 p30 -150.71 150.52 31.16 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.079 -1.082 . . . . 1.52 108.079 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.562 HG21 ' NE2' ' A' ' 67' ' ' HIS . 4.7 m -77.04 -16.12 59.38 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.87 -0.332 . . . . 1.18 111.694 -171.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -62.45 -26.88 68.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 2.24 110.21 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.7 mt-10 -65.09 -41.37 95.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 2.26 110.583 173.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 41.2 t -69.17 -41.46 77.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.143 0.496 . . . . 1.19 110.046 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 98.0 mt -61.01 -44.33 97.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.674 -0.694 . . . . 0.55 110.057 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -51.42 69.54 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 0.57 111.661 174.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -56.93 -43.16 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.5 110.718 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.56 HD21 HD13 ' A' ' 33' ' ' LEU . 45.9 mt -68.36 -34.03 75.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.298 -0.864 . . . . 0.45 111.241 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.09 -28.52 68.25 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.739 0.304 . . . . 1.22 111.222 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -76.52 -45.13 32.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.035 0.445 . . . . 3.05 110.739 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 31.1 mmmt -67.27 -46.77 72.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.865 -0.607 . . . . 1.48 111.149 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.447 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 22.9 t -149.5 102.18 3.29 Favored Pre-proline 0 C--N 1.315 -0.919 0 C-N-CA 120.818 -0.353 . . . . 1.16 110.327 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 4.4 Cg_endo -47.09 -59.62 1.18 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 123.581 2.854 . . . . 0.58 113.346 -168.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.16 -28.04 66.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.578 -0.737 . . . . 2.45 111.283 -177.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -40.36 81.47 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.241 -1.022 . . . . 1.42 108.241 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.81 -23.08 65.08 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.365 -1.289 . . . . 0.37 112.156 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.72 -31.1 66.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.867 0.365 . . . . 0.48 110.733 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.63 -47.23 76.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.289 -0.414 . . . . 2.17 110.539 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.39 -29.0 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 1.12 110.736 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 4.9 tm-20 -60.79 -55.17 36.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.692 -0.686 . . . . 1.7 110.239 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.5 ptmm? -62.52 -30.28 71.17 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-O 121.148 0.499 . . . . 3.96 109.911 -176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.49 -1.45 15.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.514 -0.766 . . . . 1.5 111.274 -176.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.632 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 67.5 m80 -118.88 -46.79 2.53 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.241 -0.436 . . . . 2.34 110.821 175.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.42 -43.41 83.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.612 0.227 . . . . 0.4 111.612 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 33.8 mtm -61.2 -41.34 96.66 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.474 0.654 . . . . 0.72 110.237 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.0 t -71.39 -40.41 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.211 -0.904 . . . . 0.79 110.76 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 30.4 mmmt -60.55 -34.93 74.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.735 -0.666 . . . . 1.47 111.018 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.3 m -60.2 -33.0 71.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.289 0.566 . . . . 1.26 111.135 177.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.432 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.2 mttp -82.24 -42.59 18.7 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.562 -0.744 . . . . 1.54 110.194 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -69.6 -24.07 26.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.213 0.53 . . . . 0.34 111.055 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.0 -26.82 64.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.945 0.879 . . . . 0.35 109.558 174.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.34 2.5 55.82 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.32 -1.309 . . . . 0.49 110.101 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 132' ' ' PHE . 12.1 tp -96.44 136.35 37.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.533 -0.758 . . . . 0.71 109.958 -175.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.5 153.05 51.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.592 -0.813 . . . . 0.76 112.32 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -42.53 -41.31 7.91 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 124.558 3.505 . . . . 1.56 113.518 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -64.01 -49.52 72.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.948 -0.569 . . . . 2.52 110.787 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.535 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.05 -31.91 34.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.904 -0.589 . . . . 0.36 110.664 -176.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -56.02 -48.03 76.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 2.04 110.881 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.04 -40.0 94.99 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.819 -0.705 . . . . 0.41 111.917 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 121' ' ' TYR . 4.9 t80 -69.37 -44.23 71.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.74 -0.23 . . . . 1.65 111.08 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.38 -49.72 76.24 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.089 0.471 . . . . 0.41 111.047 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -67.32 -14.23 62.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.611 -0.722 . . . . 1.96 111.058 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -94.53 -46.5 6.95 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.476 -0.329 . . . . 2.12 110.691 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 p -65.25 -34.22 77.83 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.321 -0.4 . . . . 0.57 110.728 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.441 HG23 ' NH1' ' A' ' 93' ' ' ARG . 17.7 mt -55.77 -46.05 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 115.979 -0.555 . . . . 1.09 110.745 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.775 0.322 . . . . 2.82 110.989 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.63 -51.81 47.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.51 110.351 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.12 68.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.64 110.934 -178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' A' ' 66' ' ' LEU . 4.4 mpt_? -69.7 -32.79 71.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.938 -0.574 . . . . 4.42 110.28 173.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -65.61 -38.73 94.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.155 -0.545 . . . . 0.66 112.081 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.425 HD11 ' CB ' ' A' ' 113' ' ' SER . 38.9 mm -56.64 -51.04 71.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.26 0.552 . . . . 0.55 110.129 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.2 mppt? -93.8 28.64 2.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.807 -0.633 . . . . 2.7 110.181 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -108.1 -33.66 7.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.457 -0.942 . . . . 0.63 108.457 164.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.521 ' HB2' ' OD1' ' A' ' 103' ' ' ASN . 5.2 ptp180 -86.17 -9.65 56.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.543 -0.753 . . . . 3.1 109.995 175.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 12.9 m-85 -77.38 -29.97 53.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.112 -0.699 . . . . 0.97 109.112 163.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' ' HG ' ' A' ' 25' ' ' LEU . 2.5 m-85 -83.94 -52.77 6.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.515 -0.766 . . . . 1.48 111.994 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 10.5 p -59.12 -26.3 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.299 0.852 . . . . 0.87 113.299 -173.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 108.89 39.31 1.73 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.699 -0.762 . . . . 1.16 113.608 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.521 ' OD1' ' HB2' ' A' ' 98' ' ' ARG . 4.5 p30 -149.08 68.8 1.05 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.33 0.586 . . . . 1.83 109.995 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -45.12 125.89 5.53 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 114.834 -1.075 . . . . 1.75 111.944 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.48 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 58.1 Cg_endo -74.19 155.35 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.989 2.459 . . . . 0.53 111.937 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 171.63 8.96 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.145 -0.687 . . . . 1.48 109.145 173.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -62.01 -29.8 70.51 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.388 -0.525 . . . . 2.88 110.646 -176.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.36 -31.31 72.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.879 -0.6 . . . . 2.24 110.863 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.99 -46.81 70.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.375 -0.375 . . . . 1.73 110.292 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.597 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.0 mp -63.81 -43.1 97.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.82 110.031 176.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 151' ' ' PHE . 41.8 tttp -52.6 -53.29 48.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.651 -0.704 . . . . 1.74 110.528 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -62.65 -39.25 93.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.284 -0.871 . . . . 0.47 111.592 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.425 ' CB ' HD11 ' A' ' 95' ' ' ILE . 49.4 m -67.48 -44.5 78.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.841 0.682 . . . . 1.34 112.841 -178.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.597 HG13 ' O ' ' A' ' 110' ' ' LEU . 2.9 m -71.27 -28.38 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 N-CA-C 108.607 -0.886 . . . . 0.65 108.607 -179.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 84.4 tttt -53.62 -39.17 64.71 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.295 . . . . 1.72 111.25 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.566 ' O ' HD13 ' A' ' 120' ' ' LEU . 25.3 mt-10 -73.72 -36.82 65.24 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 120.113 -0.635 . . . . 2.27 111.322 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.8 m -64.77 -31.92 55.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 C-N-CA 119.98 -0.688 . . . . 0.81 110.459 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.47 HD23 ' HE2' ' A' ' 122' ' ' LYS . 6.8 mp -80.05 -31.76 39.45 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.768 -0.583 . . . . 1.21 110.483 172.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -55.12 -42.7 73.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.852 0.834 . . . . 0.95 109.369 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -77.37 -47.02 20.97 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.45 -1.25 . . . . 1.06 112.11 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.456 ' HB2' ' CE2' ' A' ' 84' ' ' PHE . 20.6 t80 -70.33 -33.75 71.85 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 119.61 -0.836 . . . . 1.54 111.775 -170.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.47 ' HE2' HD23 ' A' ' 118' ' ' LEU . 68.1 mttm -66.82 -30.6 70.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 1.98 111.174 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -84.84 -7.27 59.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.756 -0.656 . . . . 0.7 112.604 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.535 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 58.7 mtm -74.53 158.44 33.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.506 -0.478 . . . . 0.5 110.951 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 7.3 m -65.07 145.72 55.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.45 -0.341 . . . . 1.18 110.282 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.75 -47.25 70.84 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.01 0.374 . . . . 2.21 112.01 -173.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.86 -27.46 69.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.42 110.992 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.48 -34.22 29.29 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.743 -0.543 . . . . 0.31 111.743 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -66.78 -45.04 79.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 1.32 109.98 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 134' ' ' LYS . . . -68.7 -26.44 65.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.367 -0.833 . . . . 0.42 110.691 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.458 ' OD2' HD12 ' A' ' 77' ' ' LEU . 24.6 t70 -78.28 -29.28 47.87 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.209 -0.663 . . . . 0.55 109.209 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.496 ' HA ' HD11 ' A' ' 77' ' ' LEU . 84.2 t80 -66.4 -34.05 77.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 0.39 110.189 173.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.31 -13.96 65.79 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.933 -0.651 . . . . 0.27 112.704 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 130' ' ' ALA . 58.2 mttm -91.17 -16.69 27.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.224 0.535 . . . . 2.43 110.529 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.432 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 57.2 mm-40 -110.87 -35.92 5.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.617 -0.72 . . . . 1.83 110.27 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -122.68 76.41 47.01 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.589 -0.523 . . . . 0.69 109.589 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.14 -30.32 46.86 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.828 2.352 . . . . 0.63 113.074 -172.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.604 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 11.9 m-85 -77.76 -36.06 51.07 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.186 0.439 . . . . 2.31 112.186 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.3 mt -71.81 -47.53 52.67 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 119.904 -0.718 . . . . 1.02 109.716 177.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.42 72.63 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.054 0.454 . . . . 0.35 110.051 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 84.1 tttt -50.25 -73.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.272 -0.876 . . . . 2.58 111.19 171.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.7 m -65.39 -25.54 37.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.336 -0.847 . . . . 0.5 112.667 -172.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 20.0 m-30 -69.5 -50.79 41.89 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.557 -0.457 . . . . 0.62 110.606 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.7 -28.75 64.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 2.58 111.425 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.1 m -76.56 -9.45 58.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.02 0.438 . . . . 1.32 110.729 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 78.56 17.65 77.21 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 121.128 -0.558 . . . . 1.09 112.621 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.479 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 0.8 OUTLIER -74.27 -51.73 14.43 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.407 -0.59 . . . . 1.98 109.407 -178.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.6 -33.85 76.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.132 0.492 . . . . 0.34 110.166 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -60.58 -35.6 76.47 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.51 110.781 176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -73.23 -34.65 66.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.046 0.45 . . . . 2.82 110.483 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.485 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 38.1 t80 -63.56 -45.11 92.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 0.49 109.705 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -75.07 -22.24 58.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.858 -0.61 . . . . 0.59 111.519 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 110.282 -1.127 . . . . 1.62 110.282 -175.208 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.706 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 67.8 t80 . . . . . 0 N--CA 1.447 -0.585 0 CA-C-O 120.828 0.347 . . . . 1.47 110.908 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 28.8 mtmm -120.86 -83.15 0.66 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.283 -0.417 . . . . 3.15 111.018 174.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 47.4 t80 167.25 -42.74 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.669 -0.863 . . . . 2.35 108.669 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.459 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 52.7 mt-10 -66.49 -18.88 65.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.932 -1.031 . . . . 4.16 110.685 175.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.75 -5.34 57.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.522 . . . . 2.57 111.193 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 1' ' ' PHE . 44.7 mt -80.84 137.16 50.53 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 108.702 -0.851 . . . . 0.69 108.702 174.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -46.9 115.39 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.709 2.272 . . . . 0.6 111.716 176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.86 -20.55 65.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.043 -0.526 . . . . 0.57 111.209 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.03 -35.92 82.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.648 0.737 . . . . 1.37 110.097 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -83.66 -29.16 27.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.688 -1.142 . . . . 0.8 111.414 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 20.9 mtm180 -69.23 -20.85 63.96 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.508 0.671 . . . . 1.73 109.427 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -68.16 -15.14 63.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.597 -1.183 . . . . 1.02 110.473 175.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.3 mt -104.27 -0.46 28.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.93 110.827 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.5 mtt -81.67 130.32 61.82 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.605 -0.271 . . . . 1.15 111.281 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -56.43 138.59 84.65 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.731 2.287 . . . . 0.9 111.505 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.417 ' HD3' ' CG ' ' A' ' 138' ' ' PHE . 18.7 Cg_endo -59.26 -29.37 90.15 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.53 2.82 . . . . 0.96 112.79 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -70.48 -49.08 52.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.233 -0.44 . . . . 1.83 110.083 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.9 71.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 0.82 110.956 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -67.87 -40.64 83.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 2.16 111.022 177.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -52.88 -46.03 67.76 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.397 0.436 . . . . 1.06 111.278 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.635 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 30.9 t80 -57.74 -61.0 2.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 0.65 111.265 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 25' ' ' LEU . 8.2 mp -72.69 -8.25 54.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.994 0.816 . . . . 1.13 112.261 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -70.68 -57.35 4.78 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.852 0.358 . . . . 2.06 110.986 163.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.22 -37.07 33.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.036 -0.529 . . . . 1.84 111.905 -171.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.72 ' CD1' ' HB2' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -63.89 137.19 57.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 109.653 -0.499 . . . . 1.05 109.653 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.7 p -123.95 179.37 4.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.456 -0.338 . . . . 1.78 111.77 -170.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -56.45 -41.06 75.86 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.845 0.683 . . . . 2.39 112.845 -171.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.16 -34.06 82.49 Favored Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.727 -0.749 . . . . 0.93 112.481 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.72 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -85.0 -33.82 22.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.979 0.419 . . . . 2.25 109.887 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HG3' HD11 ' A' ' 25' ' ' LEU . 87.0 mttt -66.98 -10.8 53.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.557 0.694 . . . . 1.31 109.99 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 90.6 m -74.2 -31.94 62.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.871 -1.059 . . . . 0.8 110.486 174.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.642 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 10.2 p -87.14 -28.82 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 120.671 -0.411 . . . . 0.85 110.913 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.402 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.3 mm? -52.19 -48.7 64.89 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.348 0.118 . . . . 0.98 111.182 174.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -63.84 -34.18 77.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.767 0.318 . . . . 2.41 111.438 -178.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -68.9 -39.61 79.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.375 -0.375 . . . . 1.96 110.84 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.98 -43.81 38.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-O 121.177 0.513 . . . . 0.98 111.103 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.402 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 20.0 m-85 -60.2 -33.74 72.66 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 113.661 0.986 . . . . 0.83 113.661 174.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -92.52 9.39 34.71 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.656 -0.818 . . . . 2.18 110.547 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -101.97 -78.9 0.53 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.334 -0.848 . . . . 1.56 108.887 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.532 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.59 -151.35 3.03 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.85 -0.691 . . . . 1.54 112.808 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.29 130.92 5.83 Favored 'Cis proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.163 -1.182 . . . . 1.68 110.916 -9.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.532 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 19.5 m-85 -105.55 120.29 41.27 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.438 -0.801 . . . . 1.28 111.31 -170.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -73.14 -16.86 61.44 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.089 -0.96 . . . . 3.51 110.212 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.425 HD21 ' HG3' ' A' ' 47' ' ' GLU . 6.9 p30 -144.39 174.54 10.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.233 -0.439 . . . . 1.52 110.17 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.7 m -75.89 -37.05 59.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 1.18 111.165 -177.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -60.16 -35.24 74.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.023 -0.535 . . . . 2.24 112.321 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.8 mt-10 -61.28 -36.63 80.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.895 0.378 . . . . 2.26 110.985 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 30.0 t -74.34 -34.91 63.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.853 -0.425 . . . . 1.19 109.853 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.6 mt -62.92 -42.26 95.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.561 0.696 . . . . 0.55 109.6 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.85 76.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.667 -1.151 . . . . 0.57 111.802 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.05 79.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.087 -0.506 . . . . 0.5 110.896 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.99 -40.32 83.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 0.45 110.855 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -62.38 -34.71 77.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.692 0.282 . . . . 1.22 111.657 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -66.23 -44.48 83.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.437 . . . . 3.05 110.84 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.642 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 8.5 tppt? -77.11 -56.32 4.67 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.937 0.398 . . . . 1.48 110.543 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 52.3 m -125.34 103.99 28.9 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-O 121.51 0.671 . . . . 1.16 109.992 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 19.7 Cg_endo -58.63 -56.21 1.63 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.635 2.89 . . . . 0.58 113.361 -170.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 48.6 mm-40 -73.88 -24.27 59.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.802 -0.636 . . . . 2.45 111.084 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.552 ' HG ' ' HB3' ' A' ' 29' ' ' ASP . 0.9 OUTLIER -71.05 -42.92 68.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.813 -0.81 . . . . 1.42 108.813 -178.078 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.62 -24.36 76.95 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.392 -1.276 . . . . 0.37 111.619 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.02 74.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.809 0.337 . . . . 0.48 110.82 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 66.9 mttm -60.56 -54.7 42.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.956 -0.565 . . . . 2.17 110.72 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.78 -30.21 49.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 1.12 110.958 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -61.36 -60.37 3.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.279 -0.419 . . . . 1.7 111.164 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.527 ' O ' ' HG3' ' A' ' 69' ' ' MET . 91.5 mttt -62.52 -33.2 74.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 3.96 110.345 -176.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.61 HD22 ' HB2' ' A' ' 21' ' ' PHE . 34.2 tp -64.9 -41.3 95.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.352 -0.84 . . . . 1.5 110.602 176.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -72.66 -32.09 65.59 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.955 -0.757 . . . . 2.34 108.955 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.53 -36.02 76.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.409 -1.269 . . . . 0.4 111.526 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 44.2 mtm -65.59 -51.28 60.93 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.262 0.553 . . . . 0.72 110.137 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.47 -39.68 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.312 -0.858 . . . . 0.79 110.094 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tpmt? -60.06 -40.39 89.3 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.615 -0.721 . . . . 1.47 110.439 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -61.64 -38.13 86.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.05 0.452 . . . . 1.26 110.685 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -75.55 -47.19 27.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.052 -0.522 . . . . 1.54 110.341 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.406 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 73.2 mt -63.2 -20.96 27.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.586 0.708 . . . . 0.34 110.388 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.29 -30.73 63.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.2 -0.909 . . . . 0.35 110.005 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.1 -3.2 58.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.44 -1.254 . . . . 0.49 110.008 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.3 tp -91.95 130.54 37.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.241 -0.89 . . . . 0.71 109.596 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.91 155.25 50.65 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.84 -0.695 . . . . 0.76 111.741 -178.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -44.37 -40.19 12.96 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.659 2.906 . . . . 1.56 114.073 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -62.46 -41.21 98.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 2.52 111.012 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.416 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -92.93 -32.42 14.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.144 0.497 . . . . 0.36 111.038 -177.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.0 ttpt -60.31 -39.5 87.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.615 -0.721 . . . . 2.04 111.305 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.05 -44.02 98.35 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.473 -0.87 . . . . 0.41 111.727 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -67.67 -45.57 74.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.247 . . . . 1.65 111.422 178.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.763 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -52.32 -60.21 3.49 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.239 0.337 . . . . 0.41 111.469 -176.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 32.3 mt-10 -62.4 -36.14 81.4 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.823 -0.351 . . . . 1.96 110.973 -174.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -70.5 -41.84 72.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.278 -0.419 . . . . 2.12 110.974 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.3 p -69.68 -32.48 71.12 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.936 -0.306 . . . . 0.57 110.515 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.763 HG12 ' O ' ' A' ' 85' ' ' ALA . 46.2 mm -59.51 -39.06 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.787 -0.449 . . . . 1.09 109.787 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.628 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 52.3 mt-10 -60.48 -43.07 97.35 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.343 -0.389 . . . . 2.82 110.47 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.2 mt -65.63 -46.06 90.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.51 111.05 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -31.59 71.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.225 0.535 . . . . 0.64 110.421 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.488 ' NH2' ' HG2' ' A' ' 90' ' ' GLU . 43.2 mtm180 -69.84 -35.98 75.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.871 -0.604 . . . . 4.42 110.457 174.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.3 98.22 Favored Glycine 0 N--CA 1.451 -0.325 0 O-C-N 123.325 0.391 . . . . 0.66 113.005 -176.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.9 mm -59.01 -49.07 84.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.202 0.525 . . . . 0.55 110.533 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 20.6 pttp -81.29 -7.71 59.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.866 -0.606 . . . . 2.7 111.232 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -77.34 -39.88 46.05 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.3 0.571 . . . . 0.63 109.983 174.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -86.92 10.03 17.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.613 -0.721 . . . . 3.1 109.645 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.706 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.4 m-85 -98.43 -40.23 8.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.574 -0.739 . . . . 0.97 110.017 162.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -55.35 -38.99 69.49 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.168 0.509 . . . . 1.48 111.251 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.7 p -70.66 -1.97 12.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.272 -0.876 . . . . 0.87 112.817 -173.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.7 2.31 75.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.626 -0.797 . . . . 1.16 111.345 -175.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -90.53 169.93 10.62 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.035 -0.728 . . . . 1.83 109.035 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.1 mt-10 -142.59 106.09 5.46 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.582 0.23 . . . . 1.75 110.751 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.567 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 23.0 Cg_endo -64.74 141.09 70.62 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.434 2.09 . . . . 0.53 111.304 174.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.4 t -72.56 161.26 31.02 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.055 -0.72 . . . . 1.48 109.055 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -19.63 63.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.818 0.342 . . . . 2.88 111.145 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.21 -40.92 86.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.254 -0.43 . . . . 2.24 110.185 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -58.27 -41.48 84.42 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.43 0.633 . . . . 1.73 110.243 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.53 ' O ' HG23 ' A' ' 114' ' ' VAL . 11.0 mp -64.49 -50.75 66.21 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.92 -1.036 . . . . 0.82 110.42 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -53.51 -52.82 58.38 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.404 -0.362 . . . . 1.74 110.951 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.72 86.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.912 -0.585 . . . . 0.47 111.321 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 117' ' ' VAL . 68.6 m -66.74 -39.02 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.284 -0.416 . . . . 1.34 111.586 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 110' ' ' LEU . 48.8 t -77.93 -37.54 23.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.551 0.691 . . . . 0.65 109.377 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -54.24 -39.83 67.15 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.792 -1.095 . . . . 1.72 110.727 173.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.52 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.6 tt0 -74.28 -32.4 62.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 116.569 -0.287 . . . . 2.27 110.385 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 113' ' ' SER . 99.3 t -59.21 -45.22 93.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.255 0.55 . . . . 0.81 110.358 172.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.25 -28.0 65.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.614 -0.721 . . . . 1.21 110.096 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.508 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 33.3 ttpt -61.21 -42.23 98.23 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.822 -0.807 . . . . 0.95 108.822 177.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.3 mp -71.87 -51.69 21.07 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.188 -0.915 . . . . 1.06 111.374 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.616 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -69.89 -36.92 75.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 119.223 -0.991 . . . . 1.54 111.862 -167.243 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -64.6 -30.27 71.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.826 0.346 . . . . 1.98 111.146 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.15 -4.85 59.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.506 0.558 . . . . 0.7 112.506 -176.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.502 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 55.8 mtm -75.45 161.34 29.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.5 -0.48 . . . . 0.5 111.771 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.8 m -59.67 144.15 48.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.784 -0.644 . . . . 1.18 109.785 170.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.98 -40.79 94.79 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.555 0.217 . . . . 2.21 111.378 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.34 -29.6 70.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.42 110.636 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.28 -37.56 63.17 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.446 -0.662 . . . . 0.31 111.446 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.616 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 97.1 mttt -65.76 -46.89 77.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.261 0.553 . . . . 1.32 109.902 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.36 -35.56 81.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.414 -0.812 . . . . 0.42 111.472 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -76.04 -33.59 59.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.002 0.429 . . . . 0.55 110.006 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.705 -0.679 . . . . 0.39 110.146 172.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.56 -6.31 70.69 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 116.013 -0.54 . . . . 0.27 113.451 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -95.53 -50.55 4.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.226 0.536 . . . . 2.43 110.143 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.409 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -81.01 -20.92 40.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.2 -0.909 . . . . 1.83 111.168 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -137.3 69.99 54.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.764 0.316 . . . . 0.69 111.102 174.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.17 -42.17 59.71 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.173 2.582 . . . . 0.63 113.067 -178.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.511 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 30.7 t80 -61.87 -46.73 88.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.404 -0.362 . . . . 2.31 111.37 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 80.7 mt -72.45 -43.09 64.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.023 -0.271 . . . . 1.02 110.911 -177.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.86 -39.42 77.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.762 0.315 . . . . 0.35 110.225 177.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.511 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 38.9 ttpt -47.27 -66.49 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 2.58 111.115 173.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.4 ' HA ' ' HB3' ' A' ' 147' ' ' LYS . 3.3 m -64.78 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.515 -0.766 . . . . 0.5 112.824 -174.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.511 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 21.6 m-85 -76.14 -48.99 18.52 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.847 -0.741 . . . . 0.62 110.68 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -66.24 -38.7 88.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.4 -0.363 . . . . 2.58 111.151 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 13.5 m -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 1.32 111.806 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 83.62 12.46 77.84 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.692 -0.766 . . . . 1.09 112.574 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 142' ' ' VAL . 9.7 tppt? -61.5 -53.85 50.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 1.98 110.647 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.15 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 0.34 110.657 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.66 85.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.841 -0.618 . . . . 0.51 111.071 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 41.9 mmtm -69.95 -21.07 63.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.086 0.469 . . . . 2.82 110.629 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -91.71 -39.71 11.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.758 -0.656 . . . . 0.49 110.616 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.412 ' HB2' ' HB ' ' A' ' 114' ' ' VAL . . . -85.94 -4.07 59.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.59 112.278 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 110.926 -0.87 . . . . 1.62 110.926 -174.298 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.4 p90 . . . . . 0 C--O 1.234 0.282 0 CA-C-O 120.985 0.421 . . . . 1.47 110.467 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -123.77 153.39 41.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.534 -0.543 . . . . 3.15 109.534 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -54.45 -45.32 73.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.281 0.562 . . . . 2.35 109.576 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -61.93 -27.7 69.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.148 -0.933 . . . . 4.16 112.064 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -79.44 -23.21 43.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.091 0.472 . . . . 2.57 110.329 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.44 133.71 84.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.184 -0.673 . . . . 0.69 109.184 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -44.25 110.46 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.14 2.56 . . . . 0.6 112.249 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.78 -21.84 66.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.493 -0.776 . . . . 0.57 112.209 -171.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.42 -35.42 80.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.332 0.587 . . . . 1.37 110.316 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 14' ' ' MET . 37.5 t80 -84.42 -29.4 26.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.09 -0.959 . . . . 0.8 110.956 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.62 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 11.9 mtm180 -65.95 -27.15 67.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.703 0.764 . . . . 1.73 109.059 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.41 -24.67 66.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.469 -1.241 . . . . 1.02 110.24 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.547 HD21 ' HG3' ' A' ' 147' ' ' LYS . 9.9 mt -97.55 1.78 49.33 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.639 -0.709 . . . . 0.93 110.191 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 96.0 mtp -96.47 137.37 21.54 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.153 -0.476 . . . . 1.15 110.071 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.06 142.03 95.94 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.626 2.217 . . . . 0.9 111.678 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.69 -19.07 51.58 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.464 2.776 . . . . 0.96 112.472 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 66' ' ' LEU . 4.0 mm-40 -62.57 -55.25 29.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.598 -0.728 . . . . 1.83 109.616 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.87 -28.6 65.78 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.482 -0.781 . . . . 0.82 111.01 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 35.5 mtp180 -67.12 -48.4 68.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 2.16 110.802 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 24.8 t70 -53.7 -46.82 70.86 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.515 0.198 . . . . 1.06 111.028 176.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.666 ' O ' HD23 ' A' ' 25' ' ' LEU . 40.3 t80 -53.44 -60.3 3.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.985 -0.552 . . . . 0.65 111.049 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.538 HD21 ' CE1' ' A' ' 100' ' ' TYR . 83.8 mt -74.75 -4.66 38.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 119.31 0.959 . . . . 1.13 112.388 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 37.8 mt-30 -71.92 -46.26 58.25 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 122.314 -0.241 . . . . 2.06 111.405 162.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.517 HD21 ' HA ' ' A' ' 21' ' ' PHE . 11.1 p30 -83.37 -26.88 30.09 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.525 0.565 . . . . 1.84 112.525 -175.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.666 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -63.13 134.9 56.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.841 -0.429 . . . . 1.05 109.841 166.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.8 m -159.23 55.27 0.4 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.236 0.458 . . . . 1.78 112.236 -174.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.0 t70 71.98 143.06 0.06 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.325 0.584 . . . . 2.39 111.238 176.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.02 -49.14 4.07 Favored Glycine 0 N--CA 1.451 -0.32 0 N-CA-C 110.776 -0.93 . . . . 0.93 110.776 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 4.7 p30 -78.72 -49.43 13.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.112 -0.544 . . . . 2.25 110.28 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 89.2 mttt -55.32 -26.45 40.73 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.377 0.608 . . . . 1.31 110.703 174.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 14.9 m -64.69 -32.87 74.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.212 -0.903 . . . . 0.8 111.102 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.8 p -90.62 -23.61 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.23 -0.441 . . . . 0.85 110.512 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.59 -49.03 71.39 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.49 -0.323 . . . . 0.98 110.895 171.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 20.9 ptmt -65.43 -27.67 68.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.424 -0.353 . . . . 2.41 111.407 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -67.26 -37.33 83.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 1.96 110.157 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 51' ' ' ALA . 61.4 t -73.54 -53.97 16.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.252 0.549 . . . . 0.98 110.468 177.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HE1' HD12 ' A' ' 33' ' ' LEU . 27.5 m-85 -53.93 -45.11 71.14 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.345 1.239 . . . . 0.83 114.345 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -79.08 -1.4 35.64 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 119.988 -0.685 . . . . 2.18 111.16 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -99.82 17.08 21.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.394 0.616 . . . . 1.56 109.668 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -88.06 -160.61 36.01 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.444 -0.798 . . . . 1.54 111.62 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.78 160.8 95.45 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 123.334 -1.527 . . . . 1.68 112.256 -1.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -112.52 127.29 56.02 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.136 0.493 . . . . 1.28 110.252 177.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -65.65 -21.98 66.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.862 -1.063 . . . . 3.51 110.996 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.77 141.48 20.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.735 -0.666 . . . . 1.52 110.093 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.4 m -57.72 -28.31 63.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.242 -0.89 . . . . 1.18 112.215 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.64 -34.93 69.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.256 -0.429 . . . . 2.24 111.695 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.24 -34.22 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.689 0.255 . . . . 2.26 111.689 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m -64.57 -41.02 96.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.309 0.576 . . . . 1.19 109.821 176.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.9 mt -67.19 -43.14 88.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.392 -0.822 . . . . 0.55 110.561 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -58.11 -47.25 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.364 -0.835 . . . . 0.57 110.824 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.488 ' HB3' HG13 ' A' ' 36' ' ' VAL . . . -59.38 -37.46 77.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.084 -0.507 . . . . 0.5 110.481 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.518 HD21 HD13 ' A' ' 33' ' ' LEU . 21.3 mt -69.74 -40.32 76.26 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.529 -0.759 . . . . 0.45 110.891 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -66.56 -23.5 66.22 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.848 0.356 . . . . 1.22 111.776 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -80.41 -26.59 38.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.097 0.475 . . . . 3.05 110.622 176.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.551 ' HB3' HG21 ' A' ' 32' ' ' VAL . 18.4 mmtt -91.95 -58.91 2.25 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.977 -0.556 . . . . 1.48 111.058 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.5 t -131.02 104.15 15.36 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-O 121.294 0.569 . . . . 1.16 109.493 -175.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.08 -52.9 7.48 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 123.645 2.897 . . . . 0.58 112.129 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -61.31 -41.38 96.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.612 -1.176 . . . . 2.45 112.196 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.7 -40.01 73.11 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 119.443 -0.903 . . . . 1.42 109.639 -173.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.69 -36.6 93.51 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 114.614 -1.175 . . . . 0.37 111.61 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.82 94.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.719 0.295 . . . . 0.48 110.652 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -56.99 -59.66 4.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.926 -0.579 . . . . 2.17 110.911 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.97 -32.91 59.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.421 . . . . 1.12 111.744 -177.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.603 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -62.52 -55.61 25.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 1.7 110.484 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 69' ' ' MET . 9.0 mtpm? -67.42 -33.09 74.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.548 0.69 . . . . 3.96 110.104 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 17' ' ' GLU . 15.2 tp -66.52 -50.38 63.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.959 -1.019 . . . . 1.5 111.83 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.503 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.9 OUTLIER -74.57 -21.73 59.35 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.185 -0.672 . . . . 2.34 109.185 -174.433 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.49 99.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.905 -1.043 . . . . 0.4 110.648 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 28.4 mtm -63.45 -44.3 94.9 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.483 -0.562 . . . . 0.72 109.483 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.42 -49.21 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 114.996 -1.002 . . . . 0.79 110.299 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -62.45 -36.69 83.23 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 115.554 -0.748 . . . . 1.47 111.517 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -63.79 -41.12 98.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.92 0.39 . . . . 1.26 111.211 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 60.2 mttp -67.96 -44.88 75.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.213 -0.449 . . . . 1.54 110.039 177.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.4 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 79.1 mt -68.48 -22.57 27.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.456 0.646 . . . . 0.34 110.614 177.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.14 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.791 0.805 . . . . 0.35 109.744 177.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.46 -2.04 56.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.421 -1.263 . . . . 0.49 110.397 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.9 tp -93.82 134.77 35.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.403 -0.817 . . . . 0.71 110.114 -174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.39 155.41 40.18 Favored Glycine 0 C--O 1.225 -0.445 0 CA-C-O 119.669 -0.517 . . . . 0.76 112.619 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -43.19 -43.21 10.06 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 124.072 3.182 . . . . 1.56 114.49 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -66.22 -54.13 28.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.719 0.295 . . . . 2.52 110.265 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.67 -32.0 63.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.462 -0.495 . . . . 0.36 110.59 -174.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.5 ttpt -61.53 -51.94 66.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 2.04 111.341 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.04 -34.62 89.55 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.356 -0.926 . . . . 0.41 111.214 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.86 -49.1 64.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.029 -0.585 . . . . 1.65 112.252 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.44 63.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.762 -0.654 . . . . 0.41 111.753 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.75 -20.5 63.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.899 -0.591 . . . . 1.96 111.142 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 14.4 tppt? -90.22 -42.28 11.11 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.079 0.466 . . . . 2.12 111.074 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -71.43 -43.78 66.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.99 0.424 . . . . 0.57 110.998 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.471 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 77.9 mt -67.85 -30.37 48.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 1.09 111.935 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 10.6 pt-20 -67.15 -28.73 68.37 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.15 -0.62 . . . . 2.82 109.981 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.1 mt -67.29 -45.15 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 109.401 -0.592 . . . . 0.51 109.401 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.25 -39.16 91.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.79 -0.641 . . . . 0.64 110.604 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 19.1 mtm180 -68.41 -28.75 67.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.645 -0.707 . . . . 4.42 110.617 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -73.78 -31.67 60.03 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.266 -0.492 . . . . 0.66 112.351 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.16 -50.63 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.034 0.445 . . . . 0.55 110.274 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.467 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 20.9 pttp -79.28 -7.71 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 2.7 110.942 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.407 ' HA ' ' HD2' ' A' ' 100' ' ' TYR . . . -70.43 -33.76 71.7 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.425 -0.583 . . . . 0.63 109.425 168.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.633 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 78.6 mtp180 -85.44 -3.94 59.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.805 -0.634 . . . . 3.1 110.0 175.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 20.5 m-85 -88.25 -32.21 18.64 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.988 -0.685 . . . . 0.97 109.457 166.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.538 ' CE1' HD21 ' A' ' 22' ' ' LEU . 35.2 m-85 -69.6 -54.66 12.95 Favored 'General case' 0 N--CA 1.46 0.047 0 CA-C-O 121.022 0.439 . . . . 1.48 110.631 176.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.404 ' CG2' ' HB3' ' A' ' 37' ' ' PHE . 33.0 p -61.21 -26.92 68.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.273 0.842 . . . . 0.87 113.273 -172.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 103.47 -10.7 53.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.62 -0.8 . . . . 1.16 112.141 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.633 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 91.5 m-20 -85.07 57.95 4.74 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.302 -0.258 . . . . 1.83 110.302 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.93 125.61 18.26 Favored Pre-proline 0 N--CA 1.464 0.251 0 N-CA-C 112.797 0.666 . . . . 1.75 112.797 -172.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.33 142.75 30.56 Favored 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.811 2.341 . . . . 0.53 111.324 175.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -78.18 169.47 18.21 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.493 -0.558 . . . . 1.48 109.493 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.416 ' HB2' ' NZ ' ' A' ' 107' ' ' LYS . 4.3 ttmp? -61.33 -34.59 75.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 118.26 0.482 . . . . 2.88 110.648 -174.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -65.35 -30.21 71.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.798 -0.637 . . . . 2.24 110.982 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -63.56 -40.21 96.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.246 0.546 . . . . 1.73 110.235 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.639 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -71.39 -42.42 68.41 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.515 -0.766 . . . . 0.82 110.652 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -55.76 -42.73 75.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.094 0.473 . . . . 1.74 110.068 176.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.538 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -67.51 -39.08 85.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.854 -0.612 . . . . 0.47 112.337 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.52 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 3.9 p -74.29 -33.31 63.21 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.436 0.532 . . . . 1.34 112.436 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.703 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -74.3 -27.41 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 107.83 -1.174 . . . . 0.65 107.83 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 23.0 ttmm -64.24 -35.42 80.78 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.882 -1.508 . . . . 1.72 110.775 177.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.442 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.5 mt-10 -77.02 -40.05 47.98 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.112 -0.635 . . . . 2.27 111.076 178.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 114' ' ' VAL . 5.5 m -66.79 -24.62 32.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.359 -0.536 . . . . 0.81 110.229 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -84.19 -37.83 21.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.387 -0.37 . . . . 1.21 111.117 171.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 116' ' ' GLU . 36.5 ttpt -55.86 -44.12 77.77 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.297 -1.001 . . . . 0.95 108.297 176.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.4 mp -69.25 -54.47 14.56 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 113.947 -1.478 . . . . 1.06 111.867 174.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -69.37 -31.31 69.63 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 119.684 -0.806 . . . . 1.54 111.803 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -66.33 -28.44 68.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.848 0.356 . . . . 1.98 110.976 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.83 -3.36 58.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.167 0.803 . . . . 0.7 113.167 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.0 mtm -77.4 158.18 30.2 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.851 -0.74 . . . . 0.5 110.663 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 34.6 t -66.18 149.73 49.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.796 -0.446 . . . . 1.18 109.796 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -53.11 -43.75 67.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.603 0.24 . . . . 2.21 111.266 -176.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -70.02 -34.91 73.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.42 110.973 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.5 -45.14 80.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.952 -0.567 . . . . 0.31 112.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -74.73 -24.97 58.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.328 . . . . 1.32 110.485 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.86 -45.28 94.48 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.538 0.685 . . . . 0.42 110.509 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.15 -28.93 63.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.859 -1.064 . . . . 0.55 109.679 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -62.19 -30.05 70.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.324 -0.853 . . . . 0.39 109.295 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.09 -7.24 88.58 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.664 -0.698 . . . . 0.27 112.936 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -88.98 -40.98 12.64 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-O 121.342 0.591 . . . . 2.43 110.155 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.457 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 8.6 mm100 -85.98 -30.34 22.82 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.091 -0.959 . . . . 1.83 110.57 -177.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.96 70.86 78.53 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.057 0.456 . . . . 0.69 110.635 173.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.24 -27.28 72.21 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.953 2.435 . . . . 0.63 112.088 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 25.8 t80 -66.34 -39.49 89.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.799 -0.637 . . . . 2.31 110.399 -178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.3 -42.11 17.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.105 -0.498 . . . . 1.02 110.793 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.81 -34.31 71.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.475 -0.565 . . . . 0.35 109.475 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 28.6 tptp -50.5 -75.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.163 -0.926 . . . . 2.58 111.633 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.461 HG21 ' HA ' ' A' ' 13' ' ' LEU . 1.5 m -63.68 -27.64 43.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.794 -0.639 . . . . 0.5 112.616 -172.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.79 -44.94 69.05 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.382 -0.527 . . . . 0.62 110.446 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -83.17 -27.27 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.401 -0.363 . . . . 2.58 111.265 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 9.7 t -71.51 -19.59 62.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.927 0.394 . . . . 1.32 110.67 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 102.74 -10.35 55.85 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.619 -0.801 . . . . 1.09 112.583 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.547 ' HG3' HD21 ' A' ' 13' ' ' LEU . 46.2 tptt -54.55 -48.15 72.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.854 0.359 . . . . 1.98 110.79 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.408 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -75.36 -44.77 43.27 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.24 -0.436 . . . . 0.34 110.922 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -56.13 -40.07 73.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.696 -0.684 . . . . 0.51 112.611 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 4.8 mptp? -83.41 -16.55 45.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 2.82 110.901 -177.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -78.81 -35.13 44.64 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.45 -0.574 . . . . 0.49 109.45 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.703 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.58 -27.25 51.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.754 -0.657 . . . . 0.59 110.955 176.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.289 0 C-N-CA 120.945 -0.645 . . . . 1.62 111.958 -179.557 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.457 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 55.2 t80 . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 121.533 0.682 . . . . 1.47 112.179 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 4' ' ' GLU . 1.6 tmtm? -123.12 114.91 20.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.647 -0.706 . . . . 3.15 109.21 177.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -68.35 -24.07 64.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.314 0.578 . . . . 2.35 110.204 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 2' ' ' LYS . 44.8 mt-10 -86.1 -2.73 58.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.59 -0.732 . . . . 4.16 110.394 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -94.08 -10.76 32.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.549 0.69 . . . . 2.57 109.529 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.0 mt -80.74 131.6 60.16 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.345 -0.843 . . . . 0.69 109.021 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -37.81 115.36 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.745 2.964 . . . . 0.6 112.679 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.17 -17.78 64.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.57 111.551 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -74.67 -26.58 59.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.92 0.867 . . . . 1.37 109.299 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 65.4 t80 -85.13 -31.42 23.31 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.228 -1.351 . . . . 0.8 110.656 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -67.88 -18.55 64.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.301 0.572 . . . . 1.73 110.028 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.71 -21.64 64.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.185 -0.916 . . . . 1.02 110.748 175.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.543 HD21 ' HD2' ' A' ' 147' ' ' LYS . 90.7 mt -87.4 -6.99 58.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.069 -0.514 . . . . 0.93 110.916 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 63.6 mtt -86.75 126.98 61.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.341 -0.391 . . . . 1.15 110.63 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -75.35 155.39 41.31 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.36 2.04 . . . . 0.9 111.572 175.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.17 -49.37 7.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.577 2.851 . . . . 0.96 113.492 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -51.36 -51.42 54.7 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.831 0.348 . . . . 1.83 111.605 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.34 -28.18 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.809 0.337 . . . . 0.82 111.405 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -76.55 -39.01 54.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.359 -0.382 . . . . 2.16 110.465 178.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -46.71 -55.38 7.87 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.934 0.771 . . . . 1.06 110.976 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' HB2' HD22 ' A' ' 66' ' ' LEU . 40.8 t80 -56.43 -63.39 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.673 -0.694 . . . . 0.65 112.366 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -75.1 -5.36 43.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 119.223 0.92 . . . . 1.13 111.72 -174.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -74.41 -37.49 63.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.008 0.432 . . . . 2.06 110.377 162.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.37 -48.09 74.14 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.786 -0.643 . . . . 1.84 111.717 -177.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.405 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.6 mm? -57.59 137.09 56.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.195 0.522 . . . . 1.05 110.578 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -131.58 -64.22 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.683 -0.689 . . . . 1.78 111.93 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 2.7 p-10 -135.76 -90.49 0.3 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.599 0.592 . . . . 2.39 112.599 -173.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.402 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -62.54 -19.73 60.58 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 114.153 0.421 . . . . 0.93 114.153 -171.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.574 ' O ' HG12 ' A' ' 32' ' ' VAL . 36.6 m-20 -76.82 -34.82 57.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.983 0.391 . . . . 2.25 110.93 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 1' ' ' PHE . 95.7 mttt -65.67 -27.38 68.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.524 0.678 . . . . 1.31 110.487 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 66.0 m -60.71 -38.18 84.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.917 -1.038 . . . . 0.8 111.246 176.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.623 HG21 ' HB3' ' A' ' 55' ' ' LYS . 6.2 p -89.91 -21.87 6.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.982 -0.554 . . . . 0.85 111.581 -173.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.48 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 3.1 mm? -50.41 -50.91 50.46 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.804 0.298 . . . . 0.98 111.804 172.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 9.2 ptpp? -65.72 -25.02 67.11 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.809 0.338 . . . . 2.41 111.395 -176.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.55 -31.58 68.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.224 0.535 . . . . 1.96 109.891 176.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 89.7 t -74.71 -51.19 23.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.489 -0.778 . . . . 0.98 110.19 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -53.69 -42.79 68.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.233 0.827 . . . . 0.83 113.233 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.41 21.55 2.85 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.876 -0.73 . . . . 2.18 111.023 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -122.11 12.38 10.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.827 -0.624 . . . . 1.56 110.081 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.03 -156.82 10.41 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.71 -0.677 . . . . 1.54 112.19 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.69 165.12 84.61 Favored 'Cis proline' 0 C--N 1.343 0.281 0 C-N-CA 123.809 -1.33 . . . . 1.68 112.981 0.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.462 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 54.7 m-85 -123.12 124.81 43.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.604 -0.725 . . . . 1.28 110.379 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -79.68 -20.53 46.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.211 -0.904 . . . . 3.51 110.575 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.516 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.4 p30 -144.75 174.27 11.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.142 -0.481 . . . . 1.52 110.889 -171.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.1 m -72.06 -39.5 69.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.482 -0.326 . . . . 1.18 111.091 -178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -59.05 -42.29 89.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.101 -0.499 . . . . 2.24 111.751 -172.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.7 mt-10 -54.96 -39.57 69.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.802 0.334 . . . . 2.26 111.485 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.7 m -72.71 -42.09 64.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.245 -0.434 . . . . 1.19 110.442 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 60.7 mt -65.46 -38.33 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.55 110.281 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.58 -52.51 64.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.375 -0.829 . . . . 0.57 111.186 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.74 77.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.752 -0.658 . . . . 0.5 110.328 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.489 HD22 HD22 ' A' ' 59' ' ' LEU . 37.1 mt -70.3 -40.66 74.11 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.12 -0.946 . . . . 0.45 111.41 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -66.52 -23.49 66.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.064 0.459 . . . . 1.22 111.26 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.33 -50.98 10.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 3.05 109.92 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 51.7 mmtt -67.35 -62.21 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.784 -0.643 . . . . 1.48 111.909 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -132.33 90.8 33.14 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 116.043 -0.526 . . . . 1.16 109.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -41.55 -57.51 1.43 Allowed 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.829 3.019 . . . . 0.58 113.685 -171.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 30.5 tt0 -62.69 -27.03 68.97 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.234 -0.894 . . . . 2.45 111.982 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 2.2 tt -70.79 -46.25 63.2 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.786 -1.19 . . . . 1.42 107.786 -178.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.98 -32.07 83.02 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 114.407 -1.269 . . . . 0.37 111.318 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.43 91.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.666 0.269 . . . . 0.48 110.457 174.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 61.7 mttp -54.54 -53.4 54.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.995 -0.548 . . . . 2.17 110.125 175.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.503 HG22 ' CE1' ' A' ' 21' ' ' PHE . 1.8 t -65.25 -41.61 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.708 -0.678 . . . . 1.12 111.02 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.39 -55.19 37.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.785 -0.643 . . . . 1.7 110.698 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 69' ' ' MET . 8.6 mtpm? -63.48 -41.14 98.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.343 0.592 . . . . 3.96 110.304 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 70' ' ' VAL . 16.4 tp -62.97 -50.59 70.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.331 -0.85 . . . . 1.5 112.298 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.6 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.4 p80 -77.23 -17.23 58.62 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.881 -0.785 . . . . 2.34 108.881 -172.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.0 81.12 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.625 -0.716 . . . . 0.4 109.879 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 21.5 mtm -67.86 -46.85 70.56 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.281 -0.637 . . . . 0.72 109.281 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 66' ' ' LEU . 2.3 m -62.13 -35.27 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.625 -0.716 . . . . 0.79 109.832 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -65.42 -41.99 92.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.004 -0.544 . . . . 1.47 110.663 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 m -59.71 -29.72 68.3 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.197 0.523 . . . . 1.26 110.459 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 87.7 mttt -82.11 -47.01 13.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.557 -0.747 . . . . 1.54 110.837 177.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.9 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.34 111.418 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.03 -31.12 71.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.475 0.655 . . . . 0.35 110.274 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.47 58.69 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.836 -1.074 . . . . 0.49 110.669 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.579 ' CD2' ' HA ' ' A' ' 132' ' ' PHE . 97.4 mt -43.59 140.39 1.8 Allowed 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 112.74 0.644 . . . . 0.71 112.74 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 159.6 39.23 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.592 -1.003 . . . . 0.76 110.592 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -43.5 -35.82 6.32 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.561 2.841 . . . . 1.56 113.522 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.0 -48.35 37.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.523 -0.308 . . . . 2.52 111.15 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.439 ' HB1' HD22 ' A' ' 77' ' ' LEU . . . -72.41 -34.87 68.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.333 0.587 . . . . 0.36 110.146 -174.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -58.38 -44.66 88.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.878 -1.055 . . . . 2.04 110.741 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.66 -43.97 97.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.167 -0.539 . . . . 0.41 112.54 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -66.87 -44.09 81.83 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.529 0.204 . . . . 1.65 110.951 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.69 -46.64 81.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.131 0.491 . . . . 0.41 111.28 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 45.5 mt-10 -66.32 -42.43 88.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.66 -0.7 . . . . 1.96 110.529 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.09 -46.94 69.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.396 -0.366 . . . . 2.12 111.134 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -60.39 -39.88 88.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.762 0.315 . . . . 0.57 110.757 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.1 mt -65.5 -39.69 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 116.392 -0.367 . . . . 1.09 110.818 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 54.4 mt-10 -56.62 -48.21 77.97 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.069 0.461 . . . . 2.82 110.361 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 113' ' ' SER . 74.5 mt -64.59 -44.23 96.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.471 -0.786 . . . . 0.51 110.892 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.6 66.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.05 0.452 . . . . 0.64 110.941 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -62.89 -38.72 92.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.987 -0.551 . . . . 4.42 110.78 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -71.74 -39.31 60.2 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.06 -0.591 . . . . 0.66 113.065 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.41 -54.1 38.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.854 0.359 . . . . 0.55 110.779 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.474 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -87.17 29.94 0.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 2.7 110.07 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -112.83 -34.85 5.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.994 -1.003 . . . . 0.63 108.755 164.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -80.9 -13.38 58.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 3.1 109.798 177.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 20.1 m-85 -77.38 -34.05 55.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.463 -0.569 . . . . 0.97 109.463 167.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.48 ' CZ ' ' HG ' ' A' ' 33' ' ' LEU . 1.2 m-85 -77.83 -35.92 50.65 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.956 0.724 . . . . 1.48 112.956 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -65.04 -9.63 23.54 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.586 0.587 . . . . 0.87 112.586 -174.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.89 14.68 22.42 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.754 -0.736 . . . . 1.16 111.531 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -117.88 -177.73 3.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.932 -0.396 . . . . 1.83 109.932 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.451 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.4 mt-10 -142.52 105.19 5.45 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.318 -0.401 . . . . 1.75 110.729 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.1 Cg_endo -58.1 143.85 95.94 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.835 1.69 . . . . 0.53 110.133 170.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.6 p -76.04 170.21 16.71 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.851 -0.426 . . . . 1.48 109.851 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.4 tptm -64.16 -30.37 71.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.136 -0.69 . . . . 2.88 109.136 178.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -69.86 -30.11 67.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.373 -0.831 . . . . 2.24 110.81 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -60.57 -46.28 90.81 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.801 -0.444 . . . . 1.73 109.801 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.5 mp -65.77 -44.94 84.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.529 -0.76 . . . . 0.82 110.918 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 57.6 mtpt -59.41 -39.97 85.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.173 0.511 . . . . 1.74 110.445 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -69.4 -42.89 74.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.727 -0.669 . . . . 0.47 111.413 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.421 ' HB2' HG22 ' A' ' 91' ' ' ILE . 51.2 p -61.79 -38.16 87.02 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.072 -0.251 . . . . 1.34 111.558 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 117' ' ' VAL . 7.8 m -80.76 -25.83 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.395 0.617 . . . . 0.65 109.447 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 41.1 ttmt -55.95 -44.56 78.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.701 -0.681 . . . . 1.72 110.994 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.511 ' O ' HD13 ' A' ' 120' ' ' LEU . 24.0 mt-10 -72.71 -34.21 66.98 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.271 -0.572 . . . . 2.27 111.006 -176.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.4 m -66.16 -34.03 67.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.144 -0.622 . . . . 0.81 110.505 178.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 122' ' ' LYS . 4.1 mm? -73.19 -33.78 65.59 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.923 -0.486 . . . . 1.21 110.313 172.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 116' ' ' GLU . 35.4 ttpt -59.01 -45.64 90.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.996 -0.742 . . . . 0.95 108.996 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -72.27 -49.9 31.29 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.663 -1.153 . . . . 1.06 111.53 176.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.422 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 42.4 t80 -69.79 -37.47 76.33 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 119.849 -0.741 . . . . 1.54 111.747 -168.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.498 ' HE3' HD12 ' A' ' 118' ' ' LEU . 93.0 mttt -64.46 -29.88 70.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.931 0.396 . . . . 1.98 110.896 178.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.17 -6.68 59.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.7 112.397 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.407 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 42.2 mtm -76.72 157.08 31.99 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.119 -0.633 . . . . 0.5 110.313 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 70.5 m -70.06 153.39 43.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 121.06 -0.256 . . . . 1.18 110.705 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -54.97 -46.07 75.04 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.168 0.433 . . . . 2.21 112.168 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.7 75.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.775 0.322 . . . . 0.42 111.076 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -68.14 -38.11 87.72 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.016 -0.538 . . . . 0.31 112.143 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.422 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 99.8 mttt -64.73 -46.39 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.323 0.582 . . . . 1.32 110.154 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.05 -34.41 77.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.134 -0.939 . . . . 0.42 111.443 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -74.18 -31.66 62.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.683 -0.488 . . . . 0.55 109.683 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.579 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . 89.7 t80 -64.07 -34.45 78.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.777 -0.647 . . . . 0.39 110.674 175.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.21 -4.91 57.79 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.133 -0.556 . . . . 0.27 113.475 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -91.59 -23.14 19.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.567 0.699 . . . . 2.43 110.088 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -108.81 -35.82 6.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.052 -0.976 . . . . 1.83 110.889 -173.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -128.77 71.61 81.24 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.256 -0.646 . . . . 0.69 109.256 171.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.88 -33.88 62.53 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.016 2.478 . . . . 0.63 112.75 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.621 ' O ' HG13 ' A' ' 142' ' ' VAL . 28.6 m-85 -65.98 -30.55 71.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.448 -0.342 . . . . 2.31 111.492 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.4 ' HG ' ' CE1' ' A' ' 143' ' ' PHE . 5.9 mp -77.48 -48.23 17.63 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.399 -0.52 . . . . 1.02 110.028 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.16 -31.55 65.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.545 0.688 . . . . 0.35 109.854 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 56.2 tttp -58.41 -75.09 0.05 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.804 -1.089 . . . . 2.58 111.43 171.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.5 m -64.5 -26.68 40.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 112.895 0.702 . . . . 0.5 112.895 -172.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.4 ' CE1' ' HG ' ' A' ' 139' ' ' LEU . 3.8 m-85 -71.63 -47.89 51.52 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.682 -0.407 . . . . 0.62 110.478 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.24 -23.91 47.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 2.58 111.188 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.7 t -70.71 -19.29 62.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.254 0.55 . . . . 1.32 109.775 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.471 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 96.86 -9.62 66.01 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.973 -0.632 . . . . 1.09 112.582 177.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.543 ' HD2' HD21 ' A' ' 13' ' ' LEU . 8.8 tmtm? -57.14 -50.7 71.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 1.98 110.408 -176.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.5 83.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.34 111.092 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.97 80.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.126 -0.488 . . . . 0.51 111.812 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 14.4 mmmm -75.36 -35.42 61.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.88 0.371 . . . . 2.82 110.352 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.446 ' HD1' HG21 ' A' ' 114' ' ' VAL . 22.2 t80 -61.77 -40.57 95.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.49 109.705 173.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.416 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -64.88 -42.37 94.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.602 -0.727 . . . . 0.59 111.133 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.541 0 C-N-CA 120.731 -0.747 . . . . 1.62 111.587 -175.772 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.0 p90 . . . . . 0 C--O 1.237 0.413 0 CA-C-O 121.525 0.678 . . . . 1.47 110.906 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -107.88 138.11 44.71 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.71 -0.677 . . . . 3.15 109.584 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -70.72 -17.26 62.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.433 0.635 . . . . 2.35 109.619 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -92.74 2.35 56.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.31 -0.859 . . . . 4.16 110.127 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -106.38 -16.15 14.63 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.045 -0.525 . . . . 2.57 110.134 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.6 mt -76.6 133.9 70.06 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 108.319 -0.993 . . . . 0.69 108.319 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -43.06 116.2 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.298 2.665 . . . . 0.6 112.875 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.74 -22.56 67.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.983 -0.553 . . . . 0.57 111.491 -175.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.24 -34.45 78.04 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.129 0.966 . . . . 1.37 108.925 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.427 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 64.5 t80 -85.37 -24.57 27.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.673 -1.603 . . . . 0.8 110.49 -176.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -71.78 -20.46 61.86 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.401 0.62 . . . . 1.73 109.467 177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.61 -19.08 62.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.932 -1.031 . . . . 1.02 110.371 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' A' ' 147' ' ' LYS . 61.8 mt -96.39 12.98 29.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.593 -0.731 . . . . 0.93 110.304 178.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 59.8 mtt -100.42 128.75 29.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.217 -0.447 . . . . 1.15 110.604 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 21.0 Cg_endo -62.68 137.35 63.24 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.379 2.053 . . . . 0.9 110.746 175.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.2 Cg_exo -50.49 -29.58 24.93 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.779 2.986 . . . . 0.96 113.656 -175.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.517 ' O ' HD11 ' A' ' 66' ' ' LEU . 20.2 mp0 -64.54 -50.19 68.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.072 0.463 . . . . 1.83 110.236 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.18 -29.59 69.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.554 . . . . 0.82 110.796 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -68.55 -45.56 71.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.524 . . . . 2.16 110.389 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.43 -41.13 65.74 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.45 0.469 . . . . 1.06 111.436 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.555 ' O ' HD23 ' A' ' 25' ' ' LEU . 34.2 t80 -60.59 -68.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.849 -0.614 . . . . 0.65 111.222 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.559 HD21 ' CE1' ' A' ' 100' ' ' TYR . 69.4 mt -70.01 -6.97 37.12 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 119.2 0.909 . . . . 1.13 112.069 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.81 -53.19 50.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.518 0.199 . . . . 2.06 110.801 163.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -81.0 -31.65 34.59 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.483 0.549 . . . . 1.84 112.483 -173.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -56.41 131.12 47.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.711 0.767 . . . . 1.05 111.023 173.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.1 m -124.37 178.61 5.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.593 -1.185 . . . . 1.78 109.374 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.77 -47.29 64.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.798 0.333 . . . . 2.39 111.644 -175.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.59 -48.75 79.3 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.959 -0.639 . . . . 0.93 112.538 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.614 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.1 m-20 -65.89 -43.96 86.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.708 0.29 . . . . 2.25 110.999 -178.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.07 -17.58 57.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.438 -0.346 . . . . 1.31 111.534 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.3 m -64.77 -43.64 92.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.454 0.645 . . . . 0.8 109.888 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.614 HG12 ' O ' ' A' ' 29' ' ' ASP . 2.8 p -79.21 -29.69 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 CA-C-N 115.262 -0.881 . . . . 0.85 110.082 -176.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.507 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.88 -42.41 72.04 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 121.044 0.45 . . . . 0.98 110.167 169.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HA ' HG22 ' A' ' 101' ' ' THR . 63.3 tttp -62.99 -29.64 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 2.41 111.019 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -77.99 -24.98 47.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.96 110.81 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.0 t -80.9 -57.2 5.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.717 0.77 . . . . 0.98 110.009 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.412 ' HE1' HD12 ' A' ' 33' ' ' LEU . 17.8 m-85 -54.52 -42.55 70.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.652 -1.158 . . . . 0.83 114.116 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.638 ' HE3' ' OG1' ' A' ' 101' ' ' THR . 5.1 mmpt? -86.1 8.27 21.48 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.966 -0.694 . . . . 2.18 111.346 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -102.8 -77.98 0.55 Allowed 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.512 -0.767 . . . . 1.56 108.975 169.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 44.56 -151.79 0.65 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.99 -0.624 . . . . 1.54 112.947 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -91.0 145.27 15.05 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 118.716 1.258 . . . . 1.68 111.421 -8.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.439 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 22.7 m-85 -112.18 120.42 41.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.472 0.653 . . . . 1.28 111.35 -173.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -81.13 -19.2 44.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.822 -1.081 . . . . 3.51 110.649 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.416 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -146.09 160.03 42.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.955 -0.566 . . . . 1.52 109.548 -174.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.457 ' O ' HG13 ' A' ' 49' ' ' ILE . 10.0 m -66.29 -30.57 71.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.231 -0.441 . . . . 1.18 111.947 -174.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 41.0 tt0 -59.58 -39.45 84.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.968 -0.105 . . . . 2.24 111.234 -177.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 43.7 mt-10 -60.55 -46.38 90.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.615 -0.266 . . . . 2.26 111.311 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -65.76 -34.32 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 1.19 110.919 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 45' ' ' THR . 88.6 mt -67.2 -41.79 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.55 110.21 177.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.535 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -57.4 -51.76 68.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.57 111.249 177.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.29 -42.56 77.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.5 110.511 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 18.7 mt -66.64 -39.09 88.11 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.45 111.169 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -63.92 -31.02 72.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.22 111.03 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -73.99 -46.22 45.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.257 0.551 . . . . 3.05 110.293 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 32' ' ' VAL . 61.0 mmtt -66.81 -59.0 3.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.526 -0.761 . . . . 1.48 111.737 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 m -140.65 101.98 6.54 Favored Pre-proline 0 C--N 1.311 -1.103 0 CA-C-O 121.274 0.559 . . . . 1.16 109.564 -176.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -43.52 -47.97 8.91 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.32 3.347 . . . . 0.58 112.798 -176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 11.7 pt-20 -62.86 -39.87 95.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.562 -1.199 . . . . 2.45 112.558 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -72.22 -40.86 67.48 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.758 0.79 . . . . 1.42 109.418 -172.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.08 -34.18 89.26 Favored Glycine 0 N--CA 1.441 -1.005 0 CA-C-N 114.427 -1.261 . . . . 0.37 111.62 176.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.53 -38.14 80.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.748 0.309 . . . . 0.48 110.365 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.0 mmmt -58.01 -60.16 4.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.98 -0.555 . . . . 2.17 110.697 177.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.14 -34.18 65.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 1.12 111.309 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 49' ' ' ILE . 40.5 tt0 -57.88 -66.06 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.425 . . . . 1.7 111.237 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 69' ' ' MET . 55.5 mtmt -67.04 -32.35 73.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.381 0.61 . . . . 3.96 110.641 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.517 HD11 ' O ' ' A' ' 17' ' ' GLU . 1.4 tp -65.81 -47.03 76.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.21 -0.904 . . . . 1.5 111.196 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -22.57 55.55 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.584 -0.895 . . . . 2.34 108.584 -176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.23 68.67 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.022 -0.99 . . . . 0.4 110.773 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 31.3 mtm -65.76 -46.99 76.71 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.635 -0.876 . . . . 0.72 108.635 172.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.552 ' HA ' ' HD3' ' A' ' 73' ' ' LYS . 48.3 t -58.06 -44.16 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.446 -1.252 . . . . 0.79 110.098 176.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -63.94 -39.81 95.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.321 -0.854 . . . . 1.47 110.339 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.8 t -58.97 -49.3 78.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.073 -0.512 . . . . 1.26 111.459 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -72.36 -36.27 68.72 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.056 -0.258 . . . . 1.54 111.017 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.417 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.9 mt -67.08 -30.23 48.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.085 0.469 . . . . 0.34 110.676 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.43 -30.09 71.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.431 0.634 . . . . 0.35 110.493 173.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.35 -4.5 59.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.277 -0.874 . . . . 0.49 110.697 -178.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 135' ' ' GLN . 7.4 tp -91.12 139.73 30.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.372 -0.831 . . . . 0.71 109.847 -176.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 155.61 53.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 0.76 111.967 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -44.5 -38.87 12.36 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.824 3.016 . . . . 1.56 113.835 -175.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -65.01 -57.02 9.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.116 0.484 . . . . 2.52 110.357 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -75.61 -32.37 60.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.36 110.961 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.3 ttpt -59.72 -39.5 84.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.669 -0.696 . . . . 2.04 110.726 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.28 97.71 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.259 -0.972 . . . . 0.41 111.527 177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.8 t80 -65.4 -41.94 93.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.566 0.222 . . . . 1.65 111.134 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.38 -43.43 79.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.41 111.038 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -84.72 -21.22 30.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.309 -0.405 . . . . 1.96 110.756 -177.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -73.61 -45.12 54.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.949 0.404 . . . . 2.12 110.06 176.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.7 p -62.26 -34.21 76.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.231 -0.44 . . . . 0.57 110.616 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.2 mt -68.77 -45.88 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.352 -0.386 . . . . 1.09 111.782 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.15 -29.31 70.69 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.59 -0.444 . . . . 2.82 110.922 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.9 mt -75.68 -44.9 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.15 0.5 . . . . 0.51 109.937 175.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.423 ' O ' ' HD3' ' A' ' 96' ' ' LYS . . . -64.54 -31.2 72.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.829 -0.623 . . . . 0.64 110.864 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -56.59 -51.89 66.93 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.092 -0.503 . . . . 4.42 110.582 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.73 94.7 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.996 -0.621 . . . . 0.66 112.961 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.8 mm -63.83 -52.85 51.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.342 . . . . 0.55 111.095 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 100' ' ' TYR . 9.9 mptt -83.86 -13.29 53.99 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.311 -0.556 . . . . 2.7 110.806 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.82 -24.94 67.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 118.327 0.512 . . . . 0.63 110.101 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.3 mtp180 -87.77 -24.84 23.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.074 -0.512 . . . . 3.1 110.072 175.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -75.2 -37.97 60.95 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.97 109.796 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.559 ' CE1' HD21 ' A' ' 22' ' ' LEU . 3.3 m-85 -52.85 -27.58 19.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.544 -0.753 . . . . 1.48 112.838 -176.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.638 ' OG1' ' HE3' ' A' ' 38' ' ' LYS . 17.5 p -131.05 32.96 4.23 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 118.427 -1.309 . . . . 0.87 113.273 -176.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 79.62 1.41 86.65 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.699 -0.763 . . . . 1.16 114.003 170.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 90.4 m-20 -88.71 52.81 2.52 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.969 -0.752 . . . . 1.83 108.969 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.505 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 34.3 mt-10 -53.1 115.41 7.45 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 114.469 -1.241 . . . . 1.75 113.395 -169.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 19.4 Cg_endo -64.61 154.07 74.12 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.859 2.373 . . . . 0.53 111.178 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.454 HG23 ' H ' ' A' ' 108' ' ' ASP . 13.5 t -87.22 173.08 9.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.263 -0.643 . . . . 1.48 109.263 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -64.69 -22.91 67.09 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.224 -0.59 . . . . 2.88 110.787 -175.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.454 ' H ' HG23 ' A' ' 106' ' ' THR . 18.2 m-20 -62.79 -44.16 96.91 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.175 -0.306 . . . . 2.24 110.175 175.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -57.26 -44.23 83.71 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.304 0.573 . . . . 1.73 110.214 177.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.9 mp -68.04 -48.53 65.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.126 -0.943 . . . . 0.82 111.213 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -63.94 -32.39 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.018 0.437 . . . . 1.74 110.211 -177.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.07 65.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.47 111.423 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.0 p -62.49 -34.86 77.7 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.831 0.308 . . . . 1.34 111.831 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 152' ' ' ALA . 2.7 m -84.49 -24.15 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.674 0.749 . . . . 0.65 109.286 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -62.75 -42.77 99.83 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.126 -0.943 . . . . 1.72 111.28 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.578 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.8 mt-10 -69.1 -36.87 78.02 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 119.985 -0.686 . . . . 2.27 110.975 -178.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -66.12 -27.53 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.103 -0.639 . . . . 0.81 109.844 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.489 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.0 mt -74.59 -37.81 62.79 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.693 -0.484 . . . . 1.21 109.693 172.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -57.83 -42.71 84.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.232 0.539 . . . . 0.95 109.678 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.2 mm? -69.25 -49.79 53.03 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.343 -0.844 . . . . 1.06 111.347 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 49.1 t80 -73.47 -29.36 62.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.907 -1.117 . . . . 1.54 111.665 -169.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -70.4 -38.92 74.72 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.588 -0.523 . . . . 1.98 109.588 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -92.15 68.85 5.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.514 0.673 . . . . 0.7 110.985 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.56 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 41.8 mtm -147.77 152.4 37.66 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.978 -1.01 . . . . 0.5 109.325 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.4 m -66.55 140.36 57.97 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.293 -0.262 . . . . 1.18 110.293 175.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -51.53 -42.14 61.56 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.401 0.519 . . . . 2.21 112.401 -168.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.46 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.958 0.355 . . . . 0.42 111.958 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -82.5 -29.76 35.25 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.89 -0.671 . . . . 0.31 111.537 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -71.06 -47.78 56.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.024 0.44 . . . . 1.32 110.29 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.8 65.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.83 -0.623 . . . . 0.42 111.193 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.16 -31.12 60.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.267 -0.424 . . . . 0.55 110.258 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -61.38 -27.69 68.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.761 -0.654 . . . . 0.39 110.38 176.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.63 -13.31 78.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.066 -0.588 . . . . 0.27 113.303 -178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -87.74 -39.95 14.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.736 0.779 . . . . 2.43 109.536 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.423 ' HB2' HD13 ' A' ' 77' ' ' LEU . 2.0 mp0 -87.37 -36.11 17.97 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.662 -1.154 . . . . 1.83 111.539 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -128.78 71.67 81.3 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 120.797 0.332 . . . . 0.69 110.693 176.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -61.46 -40.51 47.49 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.906 2.404 . . . . 0.63 112.32 -176.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 60.5 t80 -62.46 -41.67 98.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 2.31 111.276 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 85.4 mt -76.02 -42.13 48.89 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.639 -0.424 . . . . 1.02 110.383 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.51 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.23 0.538 . . . . 0.35 110.05 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.6 tttt -49.63 -71.67 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.158 -0.928 . . . . 2.58 111.481 171.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.5 m -64.3 -25.85 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.406 -0.815 . . . . 0.5 112.559 -171.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -71.27 -49.71 40.18 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 119.716 -0.794 . . . . 0.62 110.132 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -73.99 -34.3 64.14 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.298 -0.41 . . . . 2.58 111.2 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.5 t -66.03 -19.54 65.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.223 -0.444 . . . . 1.32 110.502 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.48 4.79 62.15 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.59 -0.814 . . . . 1.09 112.232 178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' A' ' 13' ' ' LEU . 17.0 tptm -64.9 -51.07 63.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.813 0.339 . . . . 1.98 110.303 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.39 -40.39 81.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.01 0.433 . . . . 0.34 110.223 177.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.489 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.91 -43.99 81.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.673 -0.694 . . . . 0.51 111.554 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.94 -25.47 61.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.259 -0.428 . . . . 2.82 111.504 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -74.36 -35.54 63.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.049 0.452 . . . . 0.49 110.073 176.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.646 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -81.39 -37.09 28.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 0.59 112.017 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 110.297 -1.121 . . . . 1.62 110.297 -169.265 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.9 p90 . . . . . 0 C--O 1.235 0.302 0 CA-C-O 120.875 0.369 . . . . 1.47 110.178 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.403 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 97.9 mttt -121.39 161.59 21.86 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.324 -0.235 . . . . 3.15 110.396 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -54.22 -52.6 60.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 2.35 111.598 -174.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.492 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 68.4 mm-40 -73.88 -0.13 15.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.621 0.6 . . . . 4.16 112.621 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -91.99 -20.47 21.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 2.57 110.407 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.35 138.69 74.89 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.556 -0.905 . . . . 0.69 108.556 176.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -45.31 112.96 0.44 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.15 2.567 . . . . 0.6 112.697 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.02 67.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.732 -0.667 . . . . 0.57 111.471 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -65.25 -35.33 80.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 122.238 1.018 . . . . 1.37 109.283 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.415 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 84.8 t80 -83.92 -28.43 27.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.119 -1.4 . . . . 0.8 110.617 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 53.1 mtp180 -70.0 -18.73 63.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.556 0.693 . . . . 1.73 109.732 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -21.18 63.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.62 -1.173 . . . . 1.02 110.206 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.3 mt -94.05 -26.44 16.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.925 -0.58 . . . . 0.93 110.636 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.8 mtt -62.22 124.93 84.31 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 1.15 110.462 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.38 151.27 65.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.226 1.951 . . . . 0.9 112.529 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.405 ' HD3' ' CD2' ' A' ' 138' ' ' PHE . 88.0 Cg_exo -48.89 -50.09 13.5 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 122.851 2.367 . . . . 0.96 112.197 -177.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -77.21 42.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.924 -1.035 . . . . 1.83 111.355 -178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -156.79 -38.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.022 -0.99 . . . . 0.82 108.596 175.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -67.03 -32.09 73.07 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.34 -0.845 . . . . 2.16 110.289 173.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -50.29 -46.91 55.57 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.766 0.666 . . . . 1.06 111.477 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 43.1 t80 -58.43 -61.47 2.56 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 119.175 -0.44 . . . . 0.65 111.589 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.52 HD21 ' HE1' ' A' ' 100' ' ' TYR . 32.2 mt -73.33 -9.4 58.66 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 119.614 1.097 . . . . 1.13 112.254 -179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.61 -40.23 80.51 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.683 -0.488 . . . . 2.06 109.683 163.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -72.34 -54.1 10.44 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.628 -0.714 . . . . 1.84 110.881 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.6 mm? -53.94 126.58 22.95 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.434 0.635 . . . . 1.05 110.461 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -112.39 -73.59 0.66 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.027 -0.988 . . . . 1.78 111.17 -170.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 3.4 p-10 -140.03 -86.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.587 0.217 . . . . 2.39 111.587 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.413 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -63.01 -14.17 51.7 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 121.475 -0.393 . . . . 0.93 112.708 -178.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.0 OUTLIER -65.93 -38.07 87.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.286 0.565 . . . . 2.25 109.802 176.728 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.403 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 76.5 mttt -77.26 -9.31 58.72 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.443 0.64 . . . . 1.31 110.732 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 91.3 m -63.78 -45.81 88.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.32 -0.854 . . . . 0.8 109.801 172.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.598 HG12 ' O ' ' A' ' 29' ' ' ASP . 1.8 p -75.97 -32.77 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 114.837 -1.074 . . . . 0.85 110.406 -173.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.584 HD13 HD21 ' A' ' 52' ' ' LEU . 4.5 mm? -53.55 -52.92 58.16 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.245 -0.434 . . . . 0.98 111.443 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 7.7 ptpp? -66.78 -23.68 66.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.553 -0.294 . . . . 2.41 111.573 -175.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.9 mm-40 -72.53 -31.09 65.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.578 0.228 . . . . 1.96 110.796 176.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.8 t -74.06 -53.06 18.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.966 0.888 . . . . 0.98 109.758 174.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.3 m-85 -56.47 -42.13 77.71 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 114.628 1.344 . . . . 0.83 114.628 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 34' ' ' LYS . 9.5 mtmp? -79.94 7.53 8.72 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.129 -0.628 . . . . 2.18 111.197 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -103.1 -77.18 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.513 -0.767 . . . . 1.56 109.531 170.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 48.55 -157.48 1.03 Allowed Glycine 0 CA--C 1.523 0.566 0 C-N-CA 120.902 -0.666 . . . . 1.54 112.964 -174.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 11.7 Cg_endo -91.31 139.69 10.64 Favored 'Cis proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.287 -1.13 . . . . 1.68 111.288 -8.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 44.8 m-85 -110.07 112.24 24.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.5 0.667 . . . . 1.28 111.281 -173.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -72.71 -14.28 61.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.529 -1.214 . . . . 3.51 111.808 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.462 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -145.19 151.78 38.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.814 0.34 . . . . 1.52 111.524 -173.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.7 m -77.97 64.38 3.17 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.919 0.866 . . . . 1.18 110.122 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.462 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 28.0 tt0 -156.72 -43.54 0.07 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.9 -1.045 . . . . 2.24 108.724 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.419 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.7 mm-40 -59.0 -38.89 80.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.416 -0.811 . . . . 2.26 111.012 174.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 m -65.28 -39.56 92.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 1.19 110.02 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.0 -42.1 91.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 0.55 110.335 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.37 -49.62 73.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.788 -1.097 . . . . 0.57 111.307 175.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.97 88.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.431 0.634 . . . . 0.5 110.294 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.584 HD21 HD13 ' A' ' 33' ' ' LEU . 36.6 mt -65.49 -41.53 93.16 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.16 -0.927 . . . . 0.45 111.053 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.35 -38.22 83.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.898 0.38 . . . . 1.22 111.072 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -68.38 -40.86 81.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.599 -0.728 . . . . 3.05 111.387 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HD2' HG22 ' A' ' 32' ' ' VAL . 39.3 mttm -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.862 0.363 . . . . 1.48 111.533 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -138.68 99.58 8.46 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.339 -0.615 . . . . 1.16 109.339 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -46.3 -52.28 7.48 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.992 3.128 . . . . 0.58 112.991 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.87 -34.56 78.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.94 -1.027 . . . . 2.45 112.233 -178.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.8 mt -74.89 -39.67 61.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.103 -1.039 . . . . 1.42 109.774 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.03 -39.0 96.08 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 114.76 -1.109 . . . . 0.37 111.549 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.3 89.3 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.125 -0.324 . . . . 0.48 110.125 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -56.58 -57.38 12.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.581 -0.736 . . . . 2.17 110.761 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -65.74 -30.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 1.12 111.043 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.406 ' O ' ' HD2' ' A' ' 67' ' ' HIS . 41.7 tt0 -63.99 -60.46 3.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.399 -0.364 . . . . 1.7 110.964 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.39 -32.58 73.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.593 0.711 . . . . 3.96 110.213 -174.602 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.533 ' O ' HG23 ' A' ' 70' ' ' VAL . 8.4 tp -67.84 -45.57 74.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.993 -1.003 . . . . 1.5 111.818 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.406 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -79.99 -18.99 48.85 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.062 -0.718 . . . . 2.34 109.062 -175.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.99 85.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.004 -0.998 . . . . 0.4 110.521 173.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.49 ' O ' ' HE2' ' A' ' 73' ' ' LYS . 30.8 mtm -59.47 -45.58 91.24 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.443 0.639 . . . . 0.72 109.629 175.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 66' ' ' LEU . 60.8 t -56.04 -40.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.028 -0.987 . . . . 0.79 110.548 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -67.27 -31.71 72.22 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.844 -0.616 . . . . 1.47 111.83 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.6 m -55.35 -41.93 73.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.009 0.433 . . . . 1.26 110.713 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 69' ' ' MET . 3.0 mmtt -71.06 -43.59 67.5 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 1.54 110.182 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 74.1 mt -70.63 -21.14 22.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.4 0.619 . . . . 0.34 110.898 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.74 43.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.744 0.783 . . . . 0.35 109.547 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 0.26 57.15 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.538 -1.21 . . . . 0.49 110.324 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 77' ' ' LEU . 9.1 tp -93.07 133.04 36.63 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.71 109.818 -175.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.16 158.86 50.35 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.998 -0.62 . . . . 0.76 111.852 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.71 -34.99 22.38 Favored 'Trans proline' 0 N--CA 1.474 0.359 0 C-N-CA 123.611 2.874 . . . . 1.56 113.798 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -65.33 -55.0 20.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.06 0.457 . . . . 2.52 110.187 -178.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.3 -29.54 38.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.628 -0.714 . . . . 0.36 111.168 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.8 ttmt -56.5 -45.9 80.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.963 -0.562 . . . . 2.04 111.017 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.4 -42.07 98.79 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.792 -0.718 . . . . 0.41 111.928 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 16.9 t80 -66.06 -44.62 84.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.196 . . . . 1.65 111.12 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.1 79.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.389 -0.369 . . . . 0.41 111.403 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 26.1 mt-10 -72.35 -35.31 68.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.813 -0.355 . . . . 1.96 110.744 -178.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -66.52 -50.31 63.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.238 -0.437 . . . . 2.12 110.402 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.5 p -67.14 -38.92 86.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 0.57 111.485 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.1 mp -57.23 -39.72 69.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.334 -0.394 . . . . 1.09 111.205 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 63.6 mt-10 -72.31 -30.61 64.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.694 0.283 . . . . 2.82 111.064 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.2 mt -74.59 -55.42 12.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.75 0.31 . . . . 0.51 110.614 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.2 -50.24 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.944 -0.571 . . . . 0.64 111.22 -178.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.99 -12.96 61.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.944 -0.571 . . . . 4.42 110.971 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.73 -28.89 56.22 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.446 -0.662 . . . . 0.66 111.446 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -62.7 -49.89 81.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.031 0.443 . . . . 0.55 110.628 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.1 OUTLIER -83.1 4.08 27.9 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.258 -0.428 . . . . 2.7 110.611 177.674 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.701 ' HA ' ' CD2' ' A' ' 100' ' ' TYR . . . -89.08 -33.95 16.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.175 -0.466 . . . . 0.63 110.03 172.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.415 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 5.7 ptp180 -86.85 5.46 36.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.407 -0.59 . . . . 3.1 109.407 174.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -85.33 -37.72 19.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.304 -0.862 . . . . 0.97 109.323 163.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.701 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 26.8 m-85 -57.36 -40.89 79.03 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.273 0.559 . . . . 1.48 111.201 -176.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.0 p -66.39 -8.31 24.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.055 -0.975 . . . . 0.87 112.687 -172.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 96.57 2.49 60.04 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.665 -0.778 . . . . 1.16 111.265 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -95.43 171.01 8.96 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.356 -0.609 . . . . 1.83 109.356 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -138.66 110.07 8.02 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 116.627 -0.26 . . . . 1.75 110.873 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.415 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 19.5 Cg_endo -61.72 143.22 96.15 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.284 1.989 . . . . 0.53 111.002 173.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.456 ' O ' HD13 ' A' ' 110' ' ' LEU . 48.3 p -75.97 165.27 25.22 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.669 -0.493 . . . . 1.48 109.669 178.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -64.18 -22.39 66.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.861 -0.736 . . . . 2.88 109.972 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 111' ' ' LYS . 38.2 m-20 -72.83 -35.68 67.33 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.23 -0.441 . . . . 2.24 110.365 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -60.51 -42.3 96.11 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.253 -0.647 . . . . 1.73 109.253 173.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 106' ' ' THR . 7.1 mp -65.23 -46.73 79.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 114.987 -1.006 . . . . 0.82 110.704 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 108' ' ' ASP . 50.1 mtpt -55.47 -48.24 74.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.347 -0.388 . . . . 1.74 110.558 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.431 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -62.37 -42.38 99.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.47 111.455 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.497 ' O ' HG13 ' A' ' 117' ' ' VAL . 81.1 p -62.02 -38.59 89.25 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.312 0.486 . . . . 1.34 112.312 -176.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.566 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.7 m -83.21 -23.39 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 122.031 0.92 . . . . 0.65 109.454 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' HB1' ' A' ' 152' ' ' ALA . 36.8 ttpt -68.44 -48.74 63.78 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.451 -1.249 . . . . 1.72 111.185 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.54 ' O ' HD23 ' A' ' 120' ' ' LEU . 7.8 mm-40 -65.21 -35.91 82.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 2.27 110.829 -177.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -68.12 -26.86 35.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.662 -0.415 . . . . 0.81 110.269 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.546 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 73.8 mt -73.44 -37.73 65.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.537 -0.542 . . . . 1.21 109.537 171.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.5 ttpt -57.11 -46.41 82.64 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 109.197 -0.668 . . . . 0.95 109.197 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.3 mm? -63.21 -55.36 25.67 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.496 -0.774 . . . . 1.06 111.68 170.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 17.5 t80 -67.86 -36.04 79.6 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 119.626 -0.83 . . . . 1.54 111.936 -166.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -64.11 -25.07 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.668 0.271 . . . . 1.98 111.464 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -93.45 -5.14 49.92 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.633 0.605 . . . . 0.7 112.633 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.473 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 51.5 mtm -74.7 157.39 35.37 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.1 -0.64 . . . . 0.5 111.21 -178.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 3.6 m -59.78 151.79 24.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.167 -0.469 . . . . 1.18 110.134 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -61.38 -40.71 95.33 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.726 -0.389 . . . . 2.21 110.757 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.96 74.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.381 . . . . 0.42 110.683 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.66 -36.84 67.46 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 0.31 111.558 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' A' ' 124' ' ' MET . 96.6 mttt -66.08 -43.95 85.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.13 0.49 . . . . 1.32 110.391 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.4 -35.92 81.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.42 111.346 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.481 ' OD1' ' HD2' ' A' ' 134' ' ' LYS . 35.9 t70 -74.71 -27.97 60.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.268 0.556 . . . . 0.55 110.069 -176.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.79 -30.63 71.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.078 -0.51 . . . . 0.39 110.158 171.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.453 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -70.21 -26.02 74.82 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.27 113.929 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.481 ' HD2' ' OD1' ' A' ' 131' ' ' ASP . 15.1 ptpt -85.86 -32.12 21.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.256 0.55 . . . . 2.43 111.235 -178.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.448 ' HA ' ' NE2' ' A' ' 135' ' ' GLN . 6.7 mm100 -88.17 -41.78 12.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.676 -0.693 . . . . 1.83 110.658 -178.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.37 75.63 61.51 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-O 120.876 0.369 . . . . 0.69 110.465 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -62.68 -41.73 29.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.166 2.578 . . . . 0.63 112.713 -174.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.497 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 46.2 t80 -58.29 -44.8 88.67 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.151 -0.477 . . . . 2.31 111.1 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.79 -42.27 50.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.422 -0.353 . . . . 1.02 110.878 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.453 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.63 -40.75 84.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.35 109.94 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 85.9 tttt -46.83 -68.43 0.19 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.947 -1.024 . . . . 2.58 111.26 172.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.429 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.0 m -62.83 -28.55 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.646 -0.706 . . . . 0.5 112.637 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -73.09 -49.75 26.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.017 -0.673 . . . . 0.62 110.633 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.4 -32.54 66.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.596 -0.275 . . . . 2.58 111.463 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.4 t -71.4 -26.68 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.198 0.523 . . . . 1.32 110.52 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.05 7.02 56.66 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.604 -0.808 . . . . 1.09 112.226 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -63.35 -48.95 75.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.911 0.386 . . . . 1.98 110.554 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.0 -34.97 71.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.34 110.091 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.546 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -58.58 -54.25 49.15 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.57 -0.741 . . . . 0.51 110.466 177.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.34 -41.76 63.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 2.82 111.374 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -55.7 -46.2 77.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.49 111.269 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.511 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.17 -10.0 55.55 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.925 0.713 . . . . 0.59 112.925 -176.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.396 0 C-N-CA 120.15 -1.024 . . . . 1.62 110.845 -172.783 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.742 ' HA ' ' OE1' ' A' ' 4' ' ' GLU . 50.9 t80 . . . . . 0 C--O 1.223 -0.339 0 CA-C-O 121.286 0.565 . . . . 1.47 111.514 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -102.57 38.67 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.688 . . . . 3.15 109.527 178.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.637 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 0.4 OUTLIER 58.09 22.2 8.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.04 -1.467 . . . . 2.35 107.04 -159.117 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.742 ' OE1' ' HA ' ' A' ' 1' ' ' PHE . 12.0 mm-40 40.92 28.48 0.05 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 112.623 -2.08 . . . . 4.16 115.076 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 43.08 34.19 0.62 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.209 0.528 . . . . 2.57 110.733 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 3' ' ' TYR . 99.7 mt -53.29 134.44 51.57 Favored Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 115.887 -0.597 . . . . 0.69 111.405 -174.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -36.23 113.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.035 3.157 . . . . 0.6 112.694 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.07 -15.82 57.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.56 -0.746 . . . . 0.57 111.227 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.97 -34.41 77.7 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.243 1.02 . . . . 1.37 108.903 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -88.81 -33.09 17.54 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 113.58 -1.646 . . . . 0.8 111.122 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.438 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 32.3 mtm180 -68.61 -27.79 66.34 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.25 -0.648 . . . . 1.73 109.25 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.39 -36.15 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.16 -0.927 . . . . 1.02 110.594 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.66 -36.06 60.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.627 -0.715 . . . . 0.93 110.356 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 71.5 mtm -67.74 133.53 92.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.872 -0.603 . . . . 1.15 111.41 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.45 ' HB2' ' OE2' ' A' ' 17' ' ' GLU . 72.2 Cg_endo -76.99 163.83 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.577 2.185 . . . . 0.9 112.075 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.59 -44.23 17.49 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 123.085 2.523 . . . . 0.96 113.229 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.1 pm0 -71.79 9.23 0.94 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.752 0.649 . . . . 1.83 112.752 -176.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.06 -21.76 4.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.913 0.387 . . . . 0.82 110.736 172.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 63.9 mtp180 -91.89 -44.48 8.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.043 -0.526 . . . . 2.16 110.625 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 13.3 t70 -50.15 -50.9 47.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.544 -0.753 . . . . 1.06 111.253 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.559 ' O ' HD23 ' A' ' 25' ' ' LEU . 41.1 t80 -52.56 -62.14 1.83 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.65 111.799 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 1' ' ' PHE . 13.0 mt -74.59 -6.95 51.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 118.667 0.667 . . . . 1.13 111.05 -175.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.44 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 8.3 tp-100 -75.36 -43.27 51.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.17 0.51 . . . . 2.06 110.739 163.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -64.97 -47.63 76.9 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.583 -0.735 . . . . 1.84 111.842 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.559 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.7 mm? -53.34 132.72 39.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.48 0.657 . . . . 1.05 110.435 177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -114.1 -72.23 0.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.984 -1.007 . . . . 1.78 112.083 -173.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -140.11 -82.95 0.25 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.624 -0.43 . . . . 2.39 111.802 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.81 -29.89 71.47 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 121.464 -0.398 . . . . 0.93 113.395 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.43 -6.83 50.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.812 0.339 . . . . 2.25 111.12 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.545 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 92.4 mttt -89.48 -24.81 21.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.228 0.537 . . . . 1.31 109.864 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.5 m -62.34 -33.68 75.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.309 -0.86 . . . . 0.8 111.008 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.681 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 4.4 p -75.38 -32.11 25.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.537 -0.301 . . . . 0.85 111.713 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.425 HD12 ' CE2' ' A' ' 37' ' ' PHE . 4.0 mm? -49.88 -51.87 37.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.867 0.321 . . . . 0.98 111.867 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 63.6 pttt -64.25 -33.04 74.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.758 0.313 . . . . 2.41 110.832 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -65.86 -24.7 66.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.509 . . . . 1.96 110.735 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -91.98 -44.43 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.992 -0.549 . . . . 0.98 110.587 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 33' ' ' LEU . 18.9 m-85 -55.14 -34.49 63.81 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.748 0.647 . . . . 0.83 112.748 173.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -93.15 7.64 43.42 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.087 -0.645 . . . . 2.18 110.921 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.57 12.23 22.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.975 -0.557 . . . . 1.56 110.375 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.85 -158.48 19.44 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.88 -0.676 . . . . 1.54 112.181 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.64 163.58 87.93 Favored 'Cis proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.935 -1.277 . . . . 1.68 112.754 0.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.571 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 45.9 m-85 -121.57 134.78 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.186 -0.915 . . . . 1.28 109.599 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -81.02 -12.02 59.44 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.872 -0.604 . . . . 3.51 110.482 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.597 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -161.0 165.03 30.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.703 -0.681 . . . . 1.52 110.191 -178.415 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.9 m -64.62 -29.59 70.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.222 0.326 . . . . 1.18 111.09 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -53.1 -43.85 67.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.086 -0.506 . . . . 2.24 111.402 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.597 ' HG3' HD21 ' A' ' 44' ' ' ASN . 29.5 mt-10 -59.43 -42.11 91.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.201 -0.454 . . . . 2.26 111.215 177.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.6 t -66.32 -39.62 89.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.32 -0.4 . . . . 1.19 110.158 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.81 -41.98 93.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.54 . . . . 0.55 110.19 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.9 -50.09 74.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.164 -0.926 . . . . 0.57 111.286 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.94 -39.58 74.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.5 110.771 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 29.9 mt -69.24 -40.23 78.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.636 -0.711 . . . . 0.45 111.03 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -63.38 -31.16 72.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.774 0.321 . . . . 1.22 111.779 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.82 -38.16 70.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.176 -0.465 . . . . 3.05 111.061 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.681 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 5.2 tppt? -85.8 -56.02 3.69 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.994 0.426 . . . . 1.48 110.835 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.9 m -127.57 90.72 47.63 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.854 -0.612 . . . . 1.16 109.515 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.66 -55.41 3.58 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 124.31 3.34 . . . . 0.58 113.196 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -63.54 -32.96 74.57 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 114.603 -1.18 . . . . 2.45 112.084 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.7 -39.63 66.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.049 0.928 . . . . 1.42 108.759 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.82 88.3 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.124 -1.398 . . . . 0.37 111.436 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.32 -32.24 72.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.817 0.341 . . . . 0.48 110.662 175.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -66.96 -51.87 49.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 2.17 110.908 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.94 -24.23 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 120.851 0.358 . . . . 1.12 110.684 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -65.1 -59.29 4.28 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.257 -0.429 . . . . 1.7 110.792 177.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -34.84 77.63 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.534 0.683 . . . . 3.96 109.444 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 17' ' ' GLU . 18.0 tp -67.62 -30.35 69.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.691 -1.14 . . . . 1.5 110.657 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -83.58 -37.0 23.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 109.083 -0.71 . . . . 2.34 109.083 -177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.92 83.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.039 -0.982 . . . . 0.4 110.354 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 17' ' ' GLU . 31.9 mtp -53.6 -57.96 8.88 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.354 0.597 . . . . 0.72 110.363 173.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 66' ' ' LEU . 82.9 t -56.07 -44.85 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 114.794 -1.094 . . . . 0.79 110.881 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -64.63 -42.44 95.47 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 116.053 -0.522 . . . . 1.47 111.698 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.9 m -59.21 -35.26 73.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.168 0.509 . . . . 1.26 110.89 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 88.7 mttt -78.1 -46.7 20.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.729 -0.669 . . . . 1.54 110.552 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.2 mt -66.25 -17.22 22.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 121.844 0.83 . . . . 0.34 110.379 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.16 -34.72 56.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.986 -1.006 . . . . 0.35 110.035 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -85.35 -1.32 56.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.811 -1.086 . . . . 0.49 110.17 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 132' ' ' PHE . 7.8 tp -96.57 138.64 33.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.544 -0.753 . . . . 0.71 110.417 -175.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.56 152.8 52.44 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.934 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -41.15 -44.99 5.42 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 124.392 3.395 . . . . 1.56 114.368 -176.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 1.0 OUTLIER -69.19 -44.31 72.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 2.52 111.239 -175.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.436 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -77.29 -32.52 55.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.553 0.692 . . . . 0.36 109.817 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -52.33 -51.62 57.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.373 -1.285 . . . . 2.04 111.651 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.84 -40.8 95.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.014 -0.612 . . . . 0.41 112.363 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 14.6 t80 -68.98 -44.1 73.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.391 0.139 . . . . 1.65 110.883 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -58.05 -37.33 74.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.977 0.418 . . . . 0.41 111.046 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 44.2 mt-10 -68.14 -48.33 65.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.059 -0.519 . . . . 1.96 110.279 178.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 91' ' ' ILE . 47.2 mttm -66.05 -44.19 85.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.346 0.498 . . . . 2.12 112.346 -178.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.404 ' HA ' HG12 ' A' ' 117' ' ' VAL . 11.8 p -59.79 -45.85 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.86 0.362 . . . . 0.57 110.998 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.6 mp -60.36 -41.88 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.013 -0.539 . . . . 1.09 110.648 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 46.4 mt-10 -64.24 -52.83 56.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.654 0.242 . . . . 2.82 111.654 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.515 HG22 ' OG ' ' A' ' 113' ' ' SER . 70.6 mt -60.51 -43.85 95.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 120.868 0.366 . . . . 0.51 111.279 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.4 -46.24 73.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.079 0.466 . . . . 0.64 111.17 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -68.65 -25.97 65.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.445 -0.343 . . . . 4.42 111.781 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.64 -36.3 75.7 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.852 -0.69 . . . . 0.66 112.024 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 mm -58.91 -41.32 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.009 0.433 . . . . 0.55 111.145 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.491 ' N ' ' HD3' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -96.5 17.88 15.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.117 0.484 . . . . 2.7 110.707 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -102.22 -34.54 9.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.604 -0.725 . . . . 0.63 109.06 169.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 8.1 ptm180 -83.63 -3.23 57.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 3.1 109.954 174.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.511 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -80.27 -40.08 27.64 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.491 -0.559 . . . . 0.97 109.491 164.396 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.413 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 2.9 m-85 -68.56 -32.44 72.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.605 -0.725 . . . . 1.48 111.985 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.3 p -65.46 -15.08 62.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.87 112.06 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 107.68 10.68 26.42 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 121.11 -0.567 . . . . 1.16 111.816 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 87.5 m-20 -108.53 169.22 8.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.882 -0.414 . . . . 1.83 109.882 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.7 mt-10 -133.15 104.83 12.43 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 121.19 -0.204 . . . . 1.75 111.302 177.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.8 Cg_endo -60.38 139.53 87.08 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 121.744 1.63 . . . . 0.53 110.647 171.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.449 HG22 ' OD2' ' A' ' 109' ' ' ASP . 11.4 t -83.97 176.64 8.72 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.799 -0.445 . . . . 1.48 109.799 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.6 pptp? -63.81 -25.79 68.33 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.511 -0.476 . . . . 2.88 110.644 -176.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.87 -35.44 80.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.903 -0.59 . . . . 2.24 110.01 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.449 ' OD2' HG22 ' A' ' 106' ' ' THR . 20.6 m-20 -63.96 -45.69 88.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 1.73 110.587 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -66.38 -43.89 84.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.82 110.58 178.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 23.9 ttmm -59.38 -42.95 92.87 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.193 -0.458 . . . . 1.74 110.426 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 116' ' ' GLU . . . -68.01 -42.41 80.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.471 -0.332 . . . . 0.47 110.838 177.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.515 ' OG ' HG22 ' A' ' 91' ' ' ILE . 42.2 t -53.06 -50.26 64.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 1.34 111.096 178.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' A' ' 152' ' ' ALA . 3.8 m -77.97 -26.24 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-O 121.534 0.683 . . . . 0.65 109.639 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 62.9 tttm -60.44 -42.33 95.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.368 -0.833 . . . . 1.72 111.074 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 112' ' ' ALA . 29.8 mt-10 -73.39 -37.71 65.88 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.6 -0.44 . . . . 2.27 110.502 -177.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.73 -34.5 70.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.502 -0.479 . . . . 0.81 110.39 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.532 HD23 ' O ' ' A' ' 114' ' ' VAL . 4.0 mm? -71.64 -35.24 70.33 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.062 -0.399 . . . . 1.21 110.225 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -59.31 -40.75 87.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.956 -0.757 . . . . 0.95 108.956 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -71.9 -53.71 12.3 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.228 -0.896 . . . . 1.06 111.792 172.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 72.2 t80 -69.53 -37.04 76.95 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 119.916 -0.714 . . . . 1.54 111.914 -165.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -68.66 -28.57 67.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 1.98 110.987 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.32 56.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 0.7 112.136 -176.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 36.6 mtm -74.96 160.15 30.93 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.546 -0.461 . . . . 0.5 111.342 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.0 t -60.05 137.05 58.18 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.011 -0.737 . . . . 1.18 109.011 172.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.5 -39.51 73.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.561 -0.745 . . . . 2.21 111.691 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.59 87.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.42 110.606 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.78 66.33 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.639 -0.71 . . . . 0.31 111.46 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 129' ' ' LYS . 44.3 mtpt -64.96 -45.98 83.47 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.378 0.608 . . . . 1.32 109.714 176.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.59 78.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.387 -0.824 . . . . 0.42 110.529 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.405 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 38.2 t70 -74.16 -33.91 63.64 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.381 -0.6 . . . . 0.55 109.381 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.486 ' HA ' HD11 ' A' ' 77' ' ' LEU . 82.6 t80 -62.31 -32.39 73.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.735 -0.666 . . . . 0.39 110.343 171.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -70.39 -7.63 60.94 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.27 112.945 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 79.2 mttt -88.94 -43.45 11.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.361 0.601 . . . . 2.43 109.596 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.525 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.7 mp0 -86.34 -35.75 19.67 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.17 -0.923 . . . . 1.83 111.304 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -133.95 74.8 68.11 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.218 0.532 . . . . 0.69 110.441 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.92 -31.74 66.68 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 123.243 2.628 . . . . 0.63 112.926 -174.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' HG13 ' A' ' 142' ' ' VAL . 34.9 m-85 -61.88 -44.82 96.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.065 0.394 . . . . 2.31 112.065 -177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.404 HD21 ' HD3' ' A' ' 15' ' ' PRO . 65.6 mt -72.27 -43.72 63.88 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.506 -0.478 . . . . 1.02 110.191 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.25 -31.51 67.48 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.481 0.657 . . . . 0.35 110.451 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 25.4 ttmm -61.54 -76.94 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.094 -0.957 . . . . 2.58 111.664 173.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.553 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.0 OUTLIER -63.9 -24.35 35.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.173 -0.921 . . . . 0.5 112.636 -169.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -70.82 -41.62 71.32 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.799 -0.36 . . . . 0.62 110.47 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -81.6 -25.22 35.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.455 . . . . 2.58 110.96 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.8 m -69.67 -8.72 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.03 0.443 . . . . 1.32 110.513 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 88.64 -4.06 85.06 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.901 -0.591 . . . . 1.09 113.099 175.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -69.12 -53.94 17.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.731 0.301 . . . . 1.98 111.193 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.406 ' HB1' HD21 ' A' ' 118' ' ' LEU . . . -65.0 -39.64 93.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.409 -0.36 . . . . 0.34 110.603 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.44 -42.76 88.07 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.158 -0.474 . . . . 0.51 110.512 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -62.5 -41.7 99.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.826 0.346 . . . . 2.82 110.372 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -62.71 -34.86 78.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.942 -0.572 . . . . 0.49 110.332 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.558 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.48 -34.24 41.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.59 111.946 -178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 111.22 -0.752 . . . . 1.62 111.22 -174.923 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.467 ' CE1' ' HG3' ' A' ' 30' ' ' LYS . 18.6 p90 . . . . . 0 C--O 1.235 0.318 0 CA-C-O 121.142 0.496 . . . . 1.47 111.435 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.527 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 68.5 mttm -118.09 157.0 27.67 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.745 -0.662 . . . . 3.15 109.733 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -66.64 -18.08 65.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.464 0.649 . . . . 2.35 109.736 175.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -84.24 -14.65 49.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.313 -0.858 . . . . 4.16 110.847 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.527 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 5.5 m-20 -93.66 -6.03 47.28 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.294 0.569 . . . . 2.57 110.414 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.1 mt -85.49 135.41 38.59 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.325 -0.852 . . . . 0.69 108.952 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -46.24 114.26 0.81 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.199 2.599 . . . . 0.6 112.583 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.97 67.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.57 111.713 -176.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -63.86 -36.32 83.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.897 0.856 . . . . 1.37 109.556 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -88.27 -19.03 27.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.097 -1.411 . . . . 0.8 110.618 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -74.53 -25.49 59.37 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.502 0.668 . . . . 1.73 109.557 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.604 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 27.5 t70 -67.16 -25.16 66.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.066 -0.97 . . . . 1.02 110.36 173.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.445 HD21 ' HG3' ' A' ' 147' ' ' LYS . 98.2 mt -87.3 7.68 27.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.93 111.013 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.536 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 67.1 mtt -93.79 122.06 63.09 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.452 -0.34 . . . . 1.15 110.143 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.2 150.35 84.96 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.286 1.991 . . . . 0.9 111.159 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -45.87 -45.19 17.53 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.009 2.473 . . . . 0.96 113.246 -172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.89 -50.43 73.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.952 0.406 . . . . 1.83 111.134 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.7 -37.08 70.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.82 111.836 -174.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.536 ' HD2' ' O ' ' A' ' 14' ' ' MET . 14.0 ptm180 -76.91 -29.17 55.6 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 121.019 -0.273 . . . . 2.16 111.071 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.49 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 27.9 t70 -56.39 -45.38 80.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.712 0.292 . . . . 1.06 110.553 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 50.2 t80 -55.58 -60.35 3.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.07 -0.514 . . . . 0.65 111.823 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.499 HD21 ' CE1' ' A' ' 100' ' ' TYR . 23.1 mt -73.45 -8.11 54.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 119.791 1.178 . . . . 1.13 112.045 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 28.1 tt0 -69.07 -38.7 79.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.086 0.469 . . . . 2.06 109.875 163.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -72.15 -54.23 10.32 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.808 -0.633 . . . . 1.84 110.349 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -54.12 130.62 38.86 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.227 -0.897 . . . . 1.05 111.115 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 m -129.96 -82.34 0.55 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.508 -0.769 . . . . 1.78 110.994 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.54 154.59 43.03 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.546 -0.538 . . . . 2.39 109.546 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -45.76 3.52 Favored Glycine 0 C--N 1.322 -0.225 0 C-N-CA 120.462 -0.875 . . . . 0.93 111.694 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.51 -29.74 69.23 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 2.25 109.534 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HE3' ' HB3' ' A' ' 25' ' ' LEU . 1.5 mptm? -62.44 -18.07 60.85 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.008 -0.542 . . . . 1.31 110.361 176.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.4 m -74.4 -45.48 46.45 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.757 -0.656 . . . . 0.8 110.318 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.77 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 2.3 p -73.17 -41.77 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 120.281 -0.567 . . . . 0.85 110.917 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.598 HD12 ' HE1' ' A' ' 37' ' ' PHE . 3.8 mm? -55.94 -35.57 66.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.623 0.249 . . . . 0.98 110.837 175.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 64.2 tttm -70.27 -27.49 64.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.396 -0.365 . . . . 2.41 111.243 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.26 -28.52 14.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.629 0.252 . . . . 1.96 111.676 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 39' ' ' ALA . 74.6 t -83.94 -28.12 7.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.153 0.501 . . . . 0.98 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.598 ' HE1' HD12 ' A' ' 33' ' ' LEU . 15.0 m-85 -74.39 -24.94 59.2 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 113.895 1.072 . . . . 0.83 113.895 165.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 71.7 mmtt -75.73 -17.81 59.79 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 106.815 -1.55 . . . . 2.18 106.815 165.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 36' ' ' VAL . . . 70.16 -79.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 116.94 2.2 . . . . 1.56 116.94 154.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.79 -72.34 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 118.628 -1.749 . . . . 1.54 114.09 -157.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -88.36 172.28 30.9 Favored 'Cis proline' 0 N--CA 1.461 -0.438 0 N-CA-C 115.081 1.147 . . . . 1.68 115.081 7.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.546 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 15.4 m-85 -100.63 155.79 17.68 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.263 -1.335 . . . . 1.28 110.572 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -101.4 -12.01 18.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.72 -0.673 . . . . 3.51 110.707 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.597 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -157.66 161.84 38.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.598 -0.274 . . . . 1.52 111.365 -177.307 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.9 m -60.03 -35.16 74.5 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 123.223 0.327 . . . . 1.18 111.287 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -49.56 -38.63 31.91 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.998 -0.547 . . . . 2.24 112.135 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.597 ' HG3' HD21 ' A' ' 44' ' ' ASN . 28.3 mt-10 -70.25 -31.13 68.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.724 -0.217 . . . . 2.26 111.434 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 t -72.72 -43.08 63.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.56 -0.534 . . . . 1.19 109.56 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.39 -43.21 97.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.55 109.785 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.9 -48.23 78.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.413 -0.812 . . . . 0.57 111.139 173.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.92 86.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.448 0.642 . . . . 0.5 110.463 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 63' ' ' VAL . 30.0 mt -68.76 -40.17 79.89 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.957 -1.02 . . . . 0.45 111.215 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -66.32 -22.22 66.27 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.562 -0.455 . . . . 1.22 111.218 177.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -84.4 -33.05 23.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 3.05 110.758 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.77 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 22.8 tptp -90.57 -60.77 1.83 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.886 -0.597 . . . . 1.48 110.769 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.5 p -127.96 85.88 59.54 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 115.87 -0.604 . . . . 1.16 109.713 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.32 -60.02 0.93 Allowed 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 124.051 3.167 . . . . 0.58 113.747 -168.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.33 -26.06 68.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.649 -1.16 . . . . 2.45 111.608 -176.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 52.7 tp -75.19 -39.48 60.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.655 0.741 . . . . 1.42 109.546 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.18 -32.09 81.31 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.91 -1.041 . . . . 0.37 111.3 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -34.84 78.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.705 -0.247 . . . . 0.48 110.606 174.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 57.8 mttp -61.53 -45.08 95.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.086 0.47 . . . . 2.17 110.072 175.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.65 HG21 HD13 ' A' ' 52' ' ' LEU . 21.2 t -71.39 -38.51 69.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.859 -0.61 . . . . 1.12 110.763 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.06 -44.01 90.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.486 . . . . 1.7 111.231 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -66.01 -40.55 91.21 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.079 -0.711 . . . . 3.96 109.079 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 21' ' ' PHE . 61.5 tp -65.25 -35.25 80.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.284 -0.871 . . . . 1.5 110.722 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -73.64 -39.63 64.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.46 -0.941 . . . . 2.34 108.46 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.63 87.14 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.892 -1.049 . . . . 0.4 110.624 176.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.414 ' SD ' ' HA ' ' A' ' 66' ' ' LEU . 21.5 mtp -61.64 -57.61 11.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.306 0.574 . . . . 0.72 110.71 176.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 66' ' ' LEU . 87.4 t -58.69 -43.7 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 115.515 -0.766 . . . . 0.79 110.708 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -64.51 -34.29 77.87 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.931 -0.577 . . . . 1.47 111.563 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 38.2 t -57.98 -48.9 78.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.084 0.469 . . . . 1.26 110.287 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.515 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 62.2 mttm -66.16 -47.73 73.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.559 -0.746 . . . . 1.54 110.529 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.64 -24.51 33.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.244 0.545 . . . . 0.34 111.408 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.92 64.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.468 0.652 . . . . 0.35 110.495 174.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.39 -2.54 58.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.191 -0.913 . . . . 0.49 110.456 -178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.423 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.4 tp -95.45 130.51 42.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.686 -0.688 . . . . 0.71 110.041 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.77 152.26 46.02 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.837 -0.696 . . . . 0.76 112.11 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -40.21 -43.28 3.79 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 124.243 3.295 . . . . 1.56 114.397 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -63.9 -44.63 92.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.886 0.374 . . . . 2.52 111.159 -176.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -86.07 -30.82 22.32 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.498 -0.481 . . . . 0.36 110.411 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -57.89 -46.34 85.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.485 -0.779 . . . . 2.04 110.758 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.28 -41.06 94.78 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.885 -0.674 . . . . 0.41 112.067 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.8 t80 -69.52 -46.38 66.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.981 -0.11 . . . . 1.65 110.967 176.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.93 -47.16 78.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.118 0.485 . . . . 0.41 111.267 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.3 mt-10 -65.73 -39.66 91.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.795 -0.638 . . . . 1.96 110.704 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -74.3 -42.11 60.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.516 -0.311 . . . . 2.12 111.487 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.1 p -64.37 -39.36 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.912 0.387 . . . . 0.57 110.168 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.33 -39.92 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.773 -0.649 . . . . 1.09 110.215 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.629 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.5 mt-10 -66.48 -45.69 78.82 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 111.465 0.172 . . . . 2.82 111.465 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.436 HG22 ' OG ' ' A' ' 113' ' ' SER . 68.9 mt -61.97 -43.15 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.959 0.409 . . . . 0.51 110.546 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.04 -37.94 75.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.237 -0.438 . . . . 0.64 110.015 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -60.05 -43.01 95.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 4.42 110.964 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -63.74 -30.15 76.82 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 121.088 -0.577 . . . . 0.66 112.496 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -68.0 -46.13 82.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.772 0.32 . . . . 0.55 111.35 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -82.4 -17.78 44.25 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.576 -0.449 . . . . 2.7 110.199 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.453 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . . . -61.86 -37.9 86.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.805 0.336 . . . . 0.63 110.446 171.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 11.7 ptm180 -89.92 7.81 35.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.086 -0.506 . . . . 3.1 110.564 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.38 -41.15 9.15 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.65 -0.871 . . . . 0.97 108.65 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.499 ' CE1' HD21 ' A' ' 22' ' ' LEU . 28.5 m-85 -61.98 -34.72 76.67 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.675 -0.693 . . . . 1.48 111.342 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.3 p -73.56 1.62 9.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.209 -0.45 . . . . 0.87 112.179 -178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.432 ' HA3' ' HE2' ' A' ' 34' ' ' LYS . . . 89.16 6.41 71.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.093 -0.575 . . . . 1.16 112.356 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 80.4 m-20 -96.47 -176.8 3.74 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.049 -0.352 . . . . 1.83 110.049 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.7 mt-10 -147.3 109.3 3.92 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.606 -0.27 . . . . 1.75 110.997 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 26.2 Cg_endo -64.14 157.31 54.28 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.823 2.349 . . . . 0.53 112.162 174.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 74.4 p -81.31 171.4 14.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.753 -0.462 . . . . 1.48 109.753 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.96 -26.37 68.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.26 -0.644 . . . . 2.88 109.26 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -67.78 -39.16 84.12 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.266 -0.879 . . . . 2.24 110.611 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -59.39 -41.65 89.86 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.177 0.513 . . . . 1.73 110.448 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.443 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.8 mp -68.96 -45.03 71.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.82 110.669 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 28.8 mtpp -57.63 -48.25 79.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.216 -0.447 . . . . 1.74 110.56 177.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.47 110.989 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.508 ' O ' HG13 ' A' ' 117' ' ' VAL . 27.1 t -54.46 -49.63 69.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 1.34 111.095 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.633 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.1 m -81.44 -22.58 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.765 0.793 . . . . 0.65 109.951 -174.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 46.8 tttm -67.98 -45.68 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.784 -1.098 . . . . 1.72 111.138 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 15.1 mm-40 -70.69 -34.05 71.56 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.623 -0.431 . . . . 2.27 110.656 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.0 -31.89 55.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.616 -0.433 . . . . 0.81 110.391 176.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -73.05 -36.27 66.86 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.051 -0.352 . . . . 1.21 110.051 175.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.422 ' HD2' HD12 ' A' ' 120' ' ' LEU . 2.2 ttmm -59.5 -48.02 83.26 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.026 -0.731 . . . . 0.95 109.026 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -68.54 -45.51 71.96 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.876 -1.056 . . . . 1.06 111.768 176.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 10.4 t80 -69.52 -37.04 76.96 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.274 -0.571 . . . . 1.54 111.643 -170.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -65.16 -27.78 68.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 1.98 111.395 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.41 -6.86 59.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.089 -0.505 . . . . 0.7 112.055 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.6 mtm -76.4 153.95 35.27 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.5 110.382 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -65.8 150.25 48.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.64 -0.255 . . . . 1.18 110.559 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -54.93 -46.56 74.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.217 0.451 . . . . 2.21 112.217 -171.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.31 -32.97 70.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.42 110.926 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.14 -34.16 55.73 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.881 -0.6 . . . . 0.31 111.788 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -64.54 -45.88 85.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.076 0.465 . . . . 1.32 110.359 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.59 -28.19 65.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.42 110.86 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 15.8 t70 -77.31 -35.34 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.505 -0.554 . . . . 0.55 109.505 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -60.57 -31.02 70.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.745 -0.661 . . . . 0.39 110.297 172.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.76 -5.63 69.77 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.098 -0.572 . . . . 0.27 113.248 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 77.6 mttt -94.74 -42.06 8.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.783 0.802 . . . . 2.43 109.485 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.515 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.9 mp0 -80.96 -40.28 24.72 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.769 -1.105 . . . . 1.83 110.968 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -130.87 72.88 81.63 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.052 0.453 . . . . 0.69 110.713 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -65.47 -32.48 49.38 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.957 2.438 . . . . 0.63 112.964 -176.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.48 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 44.2 t80 -60.45 -41.77 94.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.916 0.389 . . . . 2.31 110.554 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.41 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.1 mt -77.62 -42.84 33.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.245 -0.434 . . . . 1.02 110.533 -178.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.16 -34.58 72.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.058 0.456 . . . . 0.35 110.215 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.7 tttp -52.91 -70.85 0.08 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.223 -0.899 . . . . 2.58 111.477 171.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 3.4 m -62.5 -30.41 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.165 -0.925 . . . . 0.5 112.955 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.41 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.6 m-30 -67.1 -47.89 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.134 -0.626 . . . . 0.62 110.216 -179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -72.19 -38.59 69.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 2.58 111.353 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 31.2 t -70.77 -20.68 62.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 1.32 110.705 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 96.66 2.14 60.02 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.751 -0.738 . . . . 1.09 112.372 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.604 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 44.3 tptt -56.98 -46.72 82.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.829 0.347 . . . . 1.98 110.853 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -77.89 -36.94 49.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.141 0.496 . . . . 0.34 110.34 177.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.44 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -57.69 -46.95 83.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.533 -0.758 . . . . 0.51 111.758 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -65.47 -35.49 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 2.82 110.851 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -64.07 -35.37 80.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.304 0.573 . . . . 0.49 109.872 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.598 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -78.69 -22.88 46.03 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.662 -0.699 . . . . 0.59 111.683 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.467 0 N-CA-C 111.277 -0.729 . . . . 1.62 111.277 -174.79 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.8 p90 . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.11 0.481 . . . . 1.47 110.541 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' ILE . 33.6 mmtp -120.44 139.33 52.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.177 -0.465 . . . . 3.15 109.922 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.53 -30.32 71.06 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.409 -0.589 . . . . 2.35 109.409 175.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -74.9 -19.35 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 4.16 110.698 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -89.96 -13.13 36.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.166 0.508 . . . . 2.57 110.0 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 2' ' ' LYS . 70.8 mt -77.52 129.78 76.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 109.079 -0.712 . . . . 0.69 109.079 175.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.84 113.66 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.336 2.691 . . . . 0.6 112.379 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.36 65.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.711 -0.677 . . . . 0.57 111.686 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.87 -35.57 76.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.745 0.783 . . . . 1.37 110.263 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -85.56 -29.77 23.88 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 114.585 -1.189 . . . . 0.8 111.064 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -68.45 -27.05 65.84 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.196 -0.668 . . . . 1.73 109.196 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.61 -32.27 71.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.312 -1.313 . . . . 1.02 110.615 174.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -80.57 -31.08 36.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.543 -0.753 . . . . 0.93 111.194 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 73.7 mtm -71.21 134.83 84.89 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 1.15 111.33 -176.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.4 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 44.1 Cg_endo -68.92 146.02 63.99 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.721 2.281 . . . . 0.9 112.265 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -43.74 -49.35 8.11 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 123.721 2.947 . . . . 0.96 113.813 -173.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.536 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.8 pm0 -57.56 -39.41 76.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.798 0.332 . . . . 1.83 111.811 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -14.51 60.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.774 0.321 . . . . 0.82 111.072 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 19' ' ' ARG . 16.8 mtm180 -91.39 -33.71 15.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 2.16 110.299 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.05 -45.45 32.26 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.579 . . . . 1.06 111.45 178.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.446 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 38.5 t80 -70.81 1.19 5.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.833 -0.621 . . . . 0.65 112.334 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.535 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.9 mt -127.83 -16.27 4.72 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.569 -0.707 . . . . 1.13 111.27 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.51 -41.25 98.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.886 -0.783 . . . . 2.06 108.886 164.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -75.58 -51.78 12.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.142 -0.936 . . . . 1.84 112.709 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.535 HD13 HD11 ' A' ' 33' ' ' LEU . 42.0 mt -58.14 142.04 48.43 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.951 0.882 . . . . 1.05 112.79 -172.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.0 p -136.35 -164.55 1.58 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 113.957 -1.474 . . . . 1.78 109.804 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.72 151.52 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.703 0.287 . . . . 2.39 110.432 177.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . 86.9 -45.56 3.45 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.666 -0.778 . . . . 0.93 112.374 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.618 ' O ' HG12 ' A' ' 32' ' ' VAL . 6.4 m-20 -74.67 -37.05 62.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.542 0.687 . . . . 2.25 109.733 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HA ' HD12 ' A' ' 33' ' ' LEU . 89.0 mttt -70.33 -18.02 63.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.633 -0.712 . . . . 1.31 110.194 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 53.1 m -66.89 -40.85 87.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.098 -0.955 . . . . 0.8 111.003 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.3 p -79.23 -27.06 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 0.85 110.631 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 25' ' ' LEU . 87.8 mt -56.92 -49.84 74.39 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 111.8 0.296 . . . . 0.98 111.8 177.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.0 pttm -61.09 -25.26 66.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.822 0.344 . . . . 2.41 110.884 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.78 -35.97 75.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.02 0.438 . . . . 1.96 110.438 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.2 t -73.81 -55.89 10.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.575 0.702 . . . . 0.98 110.137 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HD2' ' O ' ' A' ' 33' ' ' LEU . 72.9 m-85 -58.27 -46.56 85.81 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 114.763 1.394 . . . . 0.83 114.763 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -77.98 -13.55 59.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 118.501 0.591 . . . . 2.18 111.326 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -79.8 -78.33 0.16 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.325 -0.398 . . . . 1.56 109.997 170.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 45.94 -157.56 0.37 Allowed Glycine 0 CA--C 1.523 0.54 0 C-N-CA 121.01 -0.614 . . . . 1.54 113.394 -174.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.4 Cg_endo -91.47 172.69 21.91 Favored 'Cis proline' 0 N--CA 1.457 -0.663 0 C-N-CA 124.231 -1.154 . . . . 1.68 111.196 -7.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.49 106.53 8.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.272 0.558 . . . . 1.28 111.671 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -72.71 -18.92 61.49 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.205 -0.907 . . . . 3.51 110.026 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -145.5 157.92 43.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 1.52 109.61 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.5 m -76.13 -27.42 57.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.953 -0.567 . . . . 1.18 111.518 -174.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -58.57 -42.99 89.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.728 0.299 . . . . 2.24 110.842 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.24 -33.81 72.82 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.34 0.59 . . . . 2.26 110.896 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.8 t -74.04 -42.55 60.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 1.19 110.364 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 78.4 mt -64.32 -42.53 95.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.326 0.584 . . . . 0.55 109.886 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.34 -38.05 76.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.137 -0.938 . . . . 0.57 111.381 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.65 -38.08 80.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.412 0.625 . . . . 0.5 110.349 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.81 -35.55 67.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.289 -0.869 . . . . 0.45 111.17 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -63.37 -41.81 98.82 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 121.071 -0.252 . . . . 1.22 111.656 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.71 -33.57 66.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.929 0.395 . . . . 3.05 110.791 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.436 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 29.7 mmtm -77.82 -47.67 18.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.158 -0.474 . . . . 1.48 111.716 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -148.62 95.51 3.98 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-O 120.688 0.28 . . . . 1.16 110.67 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -41.07 -56.53 1.67 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 124.122 3.215 . . . . 0.58 113.827 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.02 -33.26 75.04 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 115.193 -0.912 . . . . 2.45 112.435 -178.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -72.25 -42.36 65.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.8 -0.815 . . . . 1.42 108.8 -176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.421 ' HA2' HG22 ' A' ' 63' ' ' VAL . . . -64.91 -33.99 88.7 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.051 -1.431 . . . . 0.37 111.449 174.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.1 72.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.763 0.316 . . . . 0.48 110.895 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 26.7 mtpp -67.03 -54.92 17.05 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.595 -0.275 . . . . 2.17 110.337 175.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.421 HG22 ' HA2' ' A' ' 60' ' ' GLY . 25.6 m -67.61 -22.61 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.166 0 C-N-CA 120.906 -0.318 . . . . 1.12 111.188 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.75 -58.26 9.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.064 -0.516 . . . . 1.7 109.838 172.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -71.95 -32.58 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.798 -0.637 . . . . 3.96 109.969 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -62.61 -41.6 99.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 1.5 109.452 179.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -74.3 -38.76 63.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.913 -0.773 . . . . 2.34 108.913 -176.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.33 95.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.821 -1.081 . . . . 0.4 111.014 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 28.9 mtp -55.88 -55.01 37.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.097 0.475 . . . . 0.72 110.8 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.453 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 69.3 t -58.58 -44.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-N 115.149 -0.932 . . . . 0.79 110.554 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -60.54 -37.51 81.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.671 -0.695 . . . . 1.47 111.512 177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.8 m -64.09 -37.78 88.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 1.26 110.859 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 95.8 mttt -72.44 -23.68 61.1 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.435 -0.348 . . . . 1.54 110.576 177.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.45 HG23 ' HB2' ' A' ' 82' ' ' LYS . 67.3 mt -89.15 -19.14 7.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.769 0.795 . . . . 0.34 110.159 175.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.03 -36.77 58.95 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.211 -0.904 . . . . 0.35 109.789 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.509 ' HB3' ' OE1' ' A' ' 135' ' ' GLN . . . -90.55 -8.01 51.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.722 -1.126 . . . . 0.49 109.448 -178.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.8 tp -86.9 121.9 30.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 106.377 -1.712 . . . . 0.71 106.377 172.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.803 ' N ' ' HD3' ' A' ' 79' ' ' PRO . . . -99.21 -12.36 42.53 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.528 1.371 . . . . 0.76 116.528 -172.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.803 ' HD3' ' N ' ' A' ' 78' ' ' GLY . 8.6 Cg_endo -98.97 -146.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.089 0 CA-C-N 121.501 2.651 . . . . 1.56 116.844 -170.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -80.01 -7.07 58.63 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 106.613 -1.625 . . . . 2.52 106.613 167.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -68.88 -36.49 78.14 Favored 'General case' 0 CA--C 1.499 -0.982 0 CA-C-N 115.361 -0.836 . . . . 0.36 109.467 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.626 ' HD2' ' O ' ' A' ' 77' ' ' LEU . 1.0 OUTLIER -72.42 -36.75 68.69 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.635 -0.711 . . . . 2.04 109.098 177.031 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.408 ' N ' ' HG2' ' A' ' 82' ' ' LYS . . . -64.36 -43.44 96.83 Favored Glycine 0 C--N 1.336 0.542 0 C-N-CA 120.091 -1.052 . . . . 0.41 111.623 174.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 8.8 t80 -66.06 -39.05 89.78 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.708 0.403 . . . . 1.65 111.063 176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.55 -43.03 79.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.483 0.658 . . . . 0.41 110.356 177.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 7.4 mm-40 -59.46 -30.88 68.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.008 -0.996 . . . . 1.96 111.108 177.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -87.37 -47.01 9.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.435 -0.348 . . . . 2.12 111.032 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.428 ' HB3' ' CE1' ' A' ' 84' ' ' PHE . 10.1 p -61.11 -47.08 87.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.198 -0.455 . . . . 0.57 111.472 -175.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.0 -40.11 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 1.09 110.279 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -62.8 -45.01 94.63 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.372 -0.377 . . . . 2.82 111.178 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -65.01 -46.56 91.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.579 -0.282 . . . . 0.51 110.932 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.73 88.46 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.299 0.571 . . . . 0.64 110.007 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt85 -59.38 -35.84 74.67 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.346 -0.843 . . . . 4.42 110.78 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.03 -35.34 90.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.018 -0.61 . . . . 0.66 112.474 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.613 HG21 HD23 ' A' ' 110' ' ' LEU . 49.1 mm -71.69 -48.22 53.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.095 0.474 . . . . 0.55 109.921 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -85.23 27.53 0.79 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.668 0.747 . . . . 2.7 110.258 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -117.06 -27.65 6.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.63 109.599 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.434 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 17.8 ptp180 -91.47 -1.03 57.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.116 -0.493 . . . . 3.1 109.997 176.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -83.65 -38.59 21.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.999 -0.741 . . . . 0.97 108.999 163.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.535 ' CE1' HD21 ' A' ' 22' ' ' LEU . 4.4 m-30 -67.86 -24.96 65.31 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.349 -0.841 . . . . 1.48 111.41 -173.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -77.65 -4.58 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.853 -0.612 . . . . 0.87 112.177 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.79 7.83 65.97 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.415 -0.897 . . . . 1.16 111.346 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -100.55 166.0 11.14 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.865 -0.791 . . . . 1.83 108.865 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 50.2 mt-10 -134.92 110.22 10.93 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 121.028 -0.269 . . . . 1.75 111.297 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 14.6 Cg_endo -61.55 151.55 79.24 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.416 2.078 . . . . 0.53 111.348 173.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.7 p -81.17 167.57 19.5 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.576 -0.527 . . . . 1.48 109.576 177.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.494 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 39.4 ttpt -64.24 -29.64 70.73 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.249 -0.649 . . . . 2.88 109.249 177.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -65.34 -36.28 83.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.241 -0.891 . . . . 2.24 110.896 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -60.69 -44.32 96.66 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.121 0.486 . . . . 1.73 109.985 173.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.613 HD23 HG21 ' A' ' 95' ' ' ILE . 61.7 mt -66.32 -40.31 89.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.298 -0.864 . . . . 0.82 111.411 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 94.5 mttt -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.091 0.472 . . . . 1.74 110.238 176.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.549 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -62.51 -43.98 97.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.765 -0.652 . . . . 0.47 111.541 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.445 ' O ' HG13 ' A' ' 117' ' ' VAL . 5.2 p -61.77 -32.25 72.51 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.38 0.511 . . . . 1.34 112.38 -177.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.9 m -87.63 -25.74 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-O 121.511 0.672 . . . . 0.65 110.126 -178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.9 ptmm? -79.61 -24.62 41.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.509 -0.769 . . . . 1.72 110.937 -175.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 20.1 mm-40 -78.76 -38.95 37.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.341 -0.543 . . . . 2.27 110.438 175.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.5 m -66.36 -29.43 46.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.611 -0.435 . . . . 0.81 110.017 176.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.91 -40.83 78.89 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.086 -0.709 . . . . 1.21 109.086 172.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 5.4 tmmm? -54.02 -46.56 71.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.731 -0.668 . . . . 0.95 110.289 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.32 -46.82 81.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.384 -0.371 . . . . 1.06 111.342 171.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 48.3 t80 -72.54 -33.52 66.91 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 119.739 -0.784 . . . . 1.54 112.41 -167.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -63.77 -32.34 73.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 1.98 110.573 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.95 -4.34 59.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.232 0.827 . . . . 0.7 113.232 -171.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 37.4 mtm -75.53 155.68 35.85 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.093 -0.643 . . . . 0.5 110.712 -178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.6 m -60.79 146.65 45.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.52 -0.309 . . . . 1.18 110.208 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.19 -47.56 75.08 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.25 0.463 . . . . 2.21 112.25 -170.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.94 -33.14 68.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.42 110.882 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -72.41 -38.33 58.23 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.477 -0.783 . . . . 0.31 111.651 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.32 -45.95 82.23 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.705 -0.48 . . . . 1.32 109.705 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.75 90.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.605 -0.725 . . . . 0.42 111.461 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.8 -29.92 70.9 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.018 0.437 . . . . 0.55 110.386 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -58.8 -27.97 65.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.718 -0.673 . . . . 0.39 110.514 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.421 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -68.56 -23.59 75.31 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.243 -0.503 . . . . 0.27 113.145 -178.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.19 21.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.938 0.399 . . . . 2.43 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.509 ' OE1' ' HB3' ' A' ' 76' ' ' ALA . 32.9 mm-40 -82.55 -46.39 13.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.713 -0.676 . . . . 1.83 112.057 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.453 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 39.0 m-85 -122.08 73.33 36.67 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 121.144 0.497 . . . . 0.69 110.107 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . 0.414 ' O ' ' HB2' ' A' ' 141' ' ' LYS . 54.9 Cg_endo -68.69 -25.79 33.66 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.994 2.463 . . . . 0.63 112.895 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' HG13 ' A' ' 142' ' ' VAL . 3.6 m-85 -68.72 -50.6 49.44 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.546 -0.297 . . . . 2.31 111.166 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.49 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -66.39 -44.35 83.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.676 -0.49 . . . . 1.02 109.676 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.421 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -55.34 -46.54 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.016 0.436 . . . . 0.35 110.612 177.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 137' ' ' PRO . 0.8 OUTLIER -47.59 -67.43 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.252 -0.886 . . . . 2.58 111.447 174.704 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.7 m -63.93 -23.07 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.014 -0.994 . . . . 0.5 112.798 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.49 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 22.2 m-30 -77.59 -44.54 28.06 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.316 -0.553 . . . . 0.62 110.746 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.07 -35.27 71.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.13 0.49 . . . . 2.58 110.13 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.1 m -82.6 167.57 18.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.37 -0.832 . . . . 1.32 110.307 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -78.79 55.25 4.2 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.895 -0.669 . . . . 1.09 111.502 176.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.502 ' HG2' ' HB ' ' A' ' 142' ' ' VAL . 15.7 tppt? -108.84 -76.3 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.228 -0.286 . . . . 1.98 110.228 -179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.2 80.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.34 110.55 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.33 68.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.51 111.471 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -85.44 -38.07 19.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.187 -0.46 . . . . 2.82 111.111 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -58.34 -39.98 80.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.157 0.503 . . . . 0.49 109.783 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.526 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -65.64 -31.52 72.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.444 -0.798 . . . . 0.59 111.093 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.454 0 C-N-CA 120.938 -0.649 . . . . 1.62 111.673 -177.706 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.6 p90 . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.037 0.446 . . . . 1.47 111.045 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.402 ' H ' ' HB3' ' A' ' 5' ' ' ASP . 68.6 mttm -113.83 165.68 12.33 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.887 -0.597 . . . . 3.15 109.68 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -55.33 -51.11 67.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 2.35 110.254 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -77.75 10.32 2.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.868 -0.605 . . . . 4.16 112.463 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 2' ' ' LYS . 30.6 t70 -102.04 -19.57 15.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.127 0.489 . . . . 2.57 110.633 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.45 ' HB ' ' HD3' ' A' ' 11' ' ' ARG . 50.9 mt -74.02 138.93 76.01 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.012 -0.736 . . . . 0.69 109.012 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.49 ' HG2' HD22 ' A' ' 110' ' ' LEU . 25.2 Cg_exo -37.69 110.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.492 2.795 . . . . 0.6 112.603 175.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' ASP . . . -70.06 -17.39 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.681 -0.691 . . . . 0.57 111.923 -171.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -69.55 -32.3 71.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.923 0.868 . . . . 1.37 108.911 176.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.444 ' CG ' HD23 ' A' ' 110' ' ' LEU . 81.1 t80 -82.57 -38.11 24.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.044 -1.435 . . . . 0.8 110.816 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' HD3' ' HB ' ' A' ' 6' ' ' ILE . 50.6 mtm180 -67.18 -27.99 67.73 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.737 0.78 . . . . 1.73 109.622 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 1.0 OUTLIER -69.93 -10.59 59.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.289 -1.323 . . . . 1.02 111.068 176.038 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.9 mt -97.95 -16.4 19.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.355 . . . . 0.93 110.311 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.3 mtm -82.24 135.13 47.77 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.316 -0.402 . . . . 1.15 111.209 -174.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.435 ' HD3' HD21 ' A' ' 139' ' ' LEU . 72.1 Cg_endo -75.48 160.62 38.38 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.881 2.387 . . . . 0.9 112.489 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -43.65 -49.1 8.2 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 123.255 2.637 . . . . 0.96 112.913 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.18 -60.03 2.76 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.087 0.47 . . . . 1.83 111.412 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 -8.46 54.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.82 112.007 -173.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -96.84 -34.66 11.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.502 -0.317 . . . . 2.16 110.749 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -52.05 -47.65 64.99 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.361 0.413 . . . . 1.06 111.645 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.485 ' O ' HD23 ' A' ' 25' ' ' LEU . 33.7 t80 -60.56 -60.24 4.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.172 -0.467 . . . . 0.65 111.571 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.488 HD21 ' CE1' ' A' ' 100' ' ' TYR . 34.6 mt -75.82 -4.65 41.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.274 0.943 . . . . 1.13 112.336 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -68.41 -36.19 78.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.498 -0.556 . . . . 2.06 109.498 163.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -78.02 -50.08 12.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.267 -0.879 . . . . 1.84 112.253 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.4 mm? -55.25 138.04 46.01 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.259 0.552 . . . . 1.05 110.786 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.3 m -121.58 -67.61 0.95 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 1.78 111.278 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -164.07 -52.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.74 0.274 . . . . 2.39 111.74 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -70.03 -30.8 69.69 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.829 -0.7 . . . . 0.93 111.552 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.708 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.5 p30 -72.53 -41.65 65.6 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.179 -0.511 . . . . 2.25 110.526 175.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.26 -20.68 63.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.13 0.49 . . . . 1.31 110.776 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 58.2 m -67.8 -30.07 69.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.936 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.708 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -90.81 -30.12 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-N 116.29 -0.414 . . . . 0.85 110.773 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.615 ' O ' HG22 ' A' ' 36' ' ' VAL . 4.4 mm? -53.92 -45.85 71.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.351 0.12 . . . . 0.98 110.967 173.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 17.8 pttp -59.9 -27.08 66.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.591 -0.444 . . . . 2.41 110.959 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -78.18 -39.02 42.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.8 0.333 . . . . 1.96 110.439 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 32' ' ' VAL . 2.3 m -69.83 -37.41 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.98 110.219 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 24.9 m-85 -67.49 -38.22 84.03 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.238 1.199 . . . . 0.83 114.238 173.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -85.25 16.87 3.33 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.627 -0.829 . . . . 2.18 110.291 -178.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.93 11.57 17.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 1.56 109.541 174.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.69 -159.97 32.72 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.521 -0.763 . . . . 1.54 111.849 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.55 160.0 93.89 Favored 'Cis proline' 0 C--O 1.233 0.274 0 C-N-CA 123.675 -1.386 . . . . 1.68 112.839 1.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.551 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 60.0 m-85 -116.6 140.92 48.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.629 -0.714 . . . . 1.28 110.106 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.3 -12.97 60.16 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.634 -0.712 . . . . 3.51 110.289 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.591 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -158.06 165.58 34.68 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.116 -0.493 . . . . 1.52 110.286 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -65.89 -30.15 70.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.118 0.485 . . . . 1.18 110.588 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -54.08 -42.82 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.435 -0.802 . . . . 2.24 112.087 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.591 ' HG3' HD21 ' A' ' 44' ' ' ASN . 30.3 mt-10 -63.76 -33.14 74.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.418 -0.355 . . . . 2.26 111.131 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.5 t -73.21 -32.23 64.66 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.849 -0.426 . . . . 1.19 109.849 177.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.7 -40.84 90.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.406 0.622 . . . . 0.55 109.556 175.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.81 -46.18 90.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.035 -0.984 . . . . 0.57 110.879 175.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.421 ' CB ' ' HB ' ' A' ' 36' ' ' VAL . . . -56.77 -39.14 73.49 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.053 -0.522 . . . . 0.5 110.973 177.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 33' ' ' LEU . 14.1 mt -71.21 -42.25 69.2 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.45 111.448 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -61.14 -34.66 75.35 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.874 0.368 . . . . 1.22 111.429 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -73.95 -38.29 64.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.056 -0.52 . . . . 3.05 111.657 -179.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -91.48 -36.89 13.49 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.228 0.455 . . . . 1.48 112.228 -175.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -145.18 88.27 6.83 Favored Pre-proline 0 C--N 1.32 -0.715 0 N-CA-C 109.336 -0.616 . . . . 1.16 109.336 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 63.1 Cg_exo -41.18 -54.41 2.59 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 124.102 3.201 . . . . 0.58 113.751 -170.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 6.1 mp0 -58.96 -36.0 74.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.945 -1.025 . . . . 2.45 112.326 -177.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.55 -36.6 79.01 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 120.011 -0.676 . . . . 1.42 109.315 -175.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.13 81.52 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.639 -1.164 . . . . 0.37 111.707 176.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 -38.79 63.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.75 0.31 . . . . 0.48 110.547 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.4 mmmt -63.2 -42.12 99.28 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.116 -0.493 . . . . 2.17 110.602 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.63 -30.07 16.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.392 -0.367 . . . . 1.12 110.718 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.46 -51.86 63.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.549 -0.296 . . . . 1.7 110.628 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 69' ' ' MET . 20.9 pttp -60.11 -35.49 75.34 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.774 0.797 . . . . 3.96 109.573 -177.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.474 HD13 ' C ' ' A' ' 66' ' ' LEU . 1.5 tm? -65.04 -48.5 73.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.387 -1.279 . . . . 1.5 110.303 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.581 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 84.2 t60 -77.98 -32.12 51.09 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.52 -0.548 . . . . 2.34 109.52 -170.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.37 93.6 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.379 -0.828 . . . . 0.4 111.528 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 60.7 mtm -56.32 -52.15 65.59 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.649 0.738 . . . . 0.72 109.367 174.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 66' ' ' LEU . 52.9 t -51.66 -49.47 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 114.107 -1.406 . . . . 0.79 110.917 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.1 mmmt -63.2 -40.63 98.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.749 . . . . 1.47 111.928 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.9 t -60.56 -40.05 90.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.022 0.439 . . . . 1.26 110.666 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 95.2 mttt -74.0 -41.71 61.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.836 -0.62 . . . . 1.54 110.788 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -69.93 -26.24 29.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.196 0.522 . . . . 0.34 110.807 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.6 81.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.579 0.704 . . . . 0.35 109.924 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.07 -2.29 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.743 -1.117 . . . . 0.49 110.743 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.471 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 11.7 tp -95.05 133.28 39.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.823 -0.626 . . . . 0.71 109.731 -176.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.41 151.2 50.54 Favored Glycine 0 C--O 1.226 -0.394 0 C-N-CA 120.8 -0.714 . . . . 0.76 112.0 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -39.17 -40.4 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.391 3.394 . . . . 1.56 114.495 -176.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -70.02 -46.24 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.263 -0.175 . . . . 2.52 111.236 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.471 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -80.29 -33.17 37.91 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.606 0.717 . . . . 0.36 109.974 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -58.03 -44.4 87.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.676 -1.147 . . . . 2.04 111.304 177.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.23 -38.83 96.29 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 0.41 111.927 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 15.4 t80 -68.47 -44.05 75.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.526 0.203 . . . . 1.65 110.998 176.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.22 85.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.034 0.445 . . . . 0.41 111.024 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -62.46 -39.71 94.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.83 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -71.06 -51.28 26.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 2.12 111.529 -177.263 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.3 p -59.15 -39.91 83.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.952 0.406 . . . . 0.57 110.997 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.7 mt -70.34 -41.03 78.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 116.091 -0.504 . . . . 1.09 111.603 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 14.8 pt-20 -69.68 -28.01 65.49 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.454 -0.498 . . . . 2.82 110.668 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 87' ' ' LYS . 98.2 mt -69.77 -48.96 61.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.014 0.435 . . . . 0.51 110.044 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.49 -33.93 76.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.92 -0.582 . . . . 0.64 110.734 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -56.96 -39.78 75.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.955 -0.566 . . . . 4.42 110.38 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 98' ' ' ARG . . . -66.98 -30.72 76.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.927 -0.654 . . . . 0.66 112.015 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -63.53 -53.8 40.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.075 0.464 . . . . 0.55 110.542 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -74.48 -15.67 60.88 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.361 -0.382 . . . . 2.7 110.863 177.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.03 71.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 119.936 -0.706 . . . . 0.63 109.989 170.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.456 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 47.1 mtt180 -88.77 -9.43 51.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.184 -0.462 . . . . 3.1 110.186 176.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.442 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 30.6 m-85 -83.25 -43.94 15.51 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.392 -0.596 . . . . 0.97 109.392 167.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.521 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 25.8 m-85 -61.08 -36.3 79.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.192 -0.458 . . . . 1.48 111.778 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 1.8 p -74.49 -11.44 60.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.87 112.737 -176.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.14 58.76 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.839 -0.696 . . . . 1.16 113.225 -176.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -88.71 -42.89 11.68 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.907 0.354 . . . . 1.83 111.236 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 65.41 88.88 0.11 Allowed Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 123.728 0.642 . . . . 1.75 112.321 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.94 144.43 5.96 Favored 'Trans proline' 0 C--O 1.237 0.457 0 C-N-CA 123.62 2.88 . . . . 0.53 113.019 172.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.7 t -79.61 166.0 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.047 -0.723 . . . . 1.48 109.047 174.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 22.0 ptmt -58.03 -34.44 70.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.283 0.492 . . . . 2.88 110.496 -176.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.99 -25.55 66.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.746 -0.661 . . . . 2.24 111.493 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -70.16 -40.59 74.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.347 0.594 . . . . 1.73 109.982 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.9 mp -72.41 -39.68 67.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.82 110.716 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.0 mtpm? -58.32 -47.02 85.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.229 0.538 . . . . 1.74 110.021 176.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -64.53 -39.25 93.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.532 -0.758 . . . . 0.47 112.301 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.9 p -71.88 -31.9 66.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.396 0.517 . . . . 1.34 112.396 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.868 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.9 m -78.41 -24.43 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.458 0.647 . . . . 0.65 109.307 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 63.5 mttm -53.26 -48.78 67.99 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.276 -0.874 . . . . 1.72 111.385 174.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' LEU . 6.4 mm-40 -70.27 -33.42 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.391 -0.368 . . . . 2.27 110.922 -171.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.3 m -67.95 -28.03 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 C-N-CA 120.231 -0.588 . . . . 0.81 109.95 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.528 HD13 ' HA ' ' A' ' 149' ' ' ALA . 44.3 mt -82.35 -30.31 30.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.81 0.338 . . . . 1.21 110.283 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -61.49 -35.42 77.61 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.607 0.718 . . . . 0.95 109.264 177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 124' ' ' MET . 10.8 mp -81.87 -45.7 15.13 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 114.755 -1.111 . . . . 1.06 111.369 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 143' ' ' PHE . 47.4 t80 -74.63 -36.32 62.91 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 119.301 -0.96 . . . . 1.54 111.611 -169.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -66.66 -29.49 69.51 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.221 -0.659 . . . . 1.98 109.221 176.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -102.22 72.1 1.28 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.189 -0.914 . . . . 0.7 110.809 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.618 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 32.0 mtm -150.02 157.47 43.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.691 -0.686 . . . . 0.5 110.669 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.4 m -62.57 138.35 58.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.228 0.537 . . . . 1.18 110.445 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -58.49 -37.88 76.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.128 -0.942 . . . . 2.21 112.533 -172.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.92 -34.83 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 0.42 110.834 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.69 -38.69 56.86 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.985 -0.626 . . . . 0.31 111.64 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.79 -45.22 90.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.042 0.448 . . . . 1.32 110.608 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.0 71.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.77 -0.65 . . . . 0.42 111.782 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -74.23 -30.72 62.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.55 109.823 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -60.32 -31.08 69.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.912 -0.586 . . . . 0.39 109.928 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.75 -12.03 73.95 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 121.092 -0.575 . . . . 0.27 112.849 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -86.51 -33.29 20.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.58 0.705 . . . . 2.43 109.781 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.6 mm-40 -92.25 -38.8 11.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.001 -1.0 . . . . 1.83 110.934 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -131.26 75.14 78.19 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-O 121.215 0.531 . . . . 0.69 110.166 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -66.86 -29.38 41.77 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.433 2.756 . . . . 0.63 113.043 -175.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.583 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 26.0 t80 -74.45 -37.04 63.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.949 0.404 . . . . 2.31 109.933 -177.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.435 HD21 ' HD3' ' A' ' 15' ' ' PRO . 79.0 mt -74.9 -46.64 34.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 1.02 110.302 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.95 -39.16 74.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.35 109.907 177.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 55.2 tttp -44.4 -68.31 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.131 -0.94 . . . . 2.58 111.701 172.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG12 ' HD3' ' A' ' 147' ' ' LYS . 2.2 m -71.9 -16.24 18.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 114.997 -1.001 . . . . 0.5 112.753 -173.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HB3' ' CD2' ' A' ' 121' ' ' TYR . 22.3 m-30 -84.95 -36.41 21.41 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.433 -0.507 . . . . 0.62 110.941 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 48.0 mt-10 -66.42 -52.35 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.081 0.467 . . . . 2.58 109.881 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -75.16 159.45 31.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.682 -0.69 . . . . 1.32 109.929 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.07 52.41 3.32 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.738 -0.744 . . . . 1.09 111.828 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.443 ' HD3' HG12 ' A' ' 142' ' ' VAL . 61.6 tttm -100.06 -64.25 1.06 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.789 0.328 . . . . 1.98 110.155 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.45 -33.76 69.64 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.301 0.572 . . . . 0.34 109.544 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.528 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -55.79 -37.91 69.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.098 -0.956 . . . . 0.51 111.55 177.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -85.81 -20.21 29.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.541 -0.3 . . . . 2.82 111.413 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.437 ' HD2' HG21 ' A' ' 114' ' ' VAL . 68.0 t80 -74.34 -34.07 63.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.532 0.682 . . . . 0.49 109.316 172.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.868 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.92 -42.53 23.89 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.189 -0.914 . . . . 0.59 111.565 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.561 0 N-CA-C 110.616 -0.994 . . . . 1.62 110.616 -170.841 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.762 ' CD1' ' HG2' ' A' ' 4' ' ' GLU . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 121.655 0.74 . . . . 1.47 111.325 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 tmtp? -100.94 50.5 0.87 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.692 -1.14 . . . . 3.15 109.435 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.456 ' CD1' HD12 ' A' ' 6' ' ' ILE . 0.9 OUTLIER 62.06 23.44 13.82 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 107.289 -1.374 . . . . 2.35 107.289 -166.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.762 ' HG2' ' CD1' ' A' ' 1' ' ' PHE . 16.0 mm-40 46.64 17.79 0.06 Allowed 'General case' 0 C--N 1.344 0.335 0 N-CA-C 116.441 2.015 . . . . 4.16 116.441 171.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.9 t70 48.97 29.98 2.59 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.47 0.652 . . . . 2.57 109.9 -172.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.456 HD12 ' CD1' ' A' ' 3' ' ' TYR . 83.2 mt -52.71 132.75 46.78 Favored Pre-proline 0 CA--C 1.519 -0.229 0 CA-C-N 115.673 -0.694 . . . . 0.69 110.376 -174.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -35.22 109.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 123.982 3.121 . . . . 0.6 112.899 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.29 -17.02 51.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.59 -0.732 . . . . 0.57 111.597 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -67.7 -35.46 78.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.703 . . . . 1.37 109.275 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.493 ' HA ' HD13 ' A' ' 13' ' ' LEU . 41.4 t80 -89.1 -24.45 22.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.383 -1.28 . . . . 0.8 111.098 -176.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -71.21 -22.93 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.041 -0.725 . . . . 1.73 109.041 177.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -24.52 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.774 -1.103 . . . . 1.02 110.541 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 10' ' ' TYR . 9.9 mp -80.37 -43.89 20.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.481 -0.781 . . . . 0.93 110.669 178.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.406 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 69.8 mtm -68.36 131.54 91.77 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 1.15 110.844 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.556 ' HD3' HD21 ' A' ' 139' ' ' LEU . 26.9 Cg_endo -63.24 152.44 79.78 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.9 111.989 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 57.6 Cg_exo -53.08 -27.46 36.65 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.621 2.88 . . . . 0.96 112.847 -178.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.56 ' O ' HD21 ' A' ' 66' ' ' LEU . 31.0 mt-10 -64.59 -50.17 68.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.898 -0.592 . . . . 1.83 110.641 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.65 70.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.998 0.428 . . . . 0.82 110.978 -178.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.406 ' HD2' ' O ' ' A' ' 14' ' ' MET . 41.0 mtp180 -75.64 -32.77 60.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.606 -0.725 . . . . 2.16 110.505 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -52.5 -45.9 66.41 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.866 -0.606 . . . . 1.06 111.318 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.528 ' O ' HD23 ' A' ' 25' ' ' LEU . 44.1 t80 -57.72 -63.21 1.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.952 -0.567 . . . . 0.65 111.657 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.523 HD21 ' CE1' ' A' ' 100' ' ' TYR . 48.9 mt -73.45 -9.91 59.18 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 119.539 1.063 . . . . 1.13 112.484 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.94 -36.89 80.9 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.013 0.435 . . . . 2.06 110.059 164.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -80.47 -48.76 12.34 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.958 -0.564 . . . . 1.84 111.142 -178.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.574 ' HB3' ' CE ' ' A' ' 30' ' ' LYS . 4.4 mm? -57.61 131.52 50.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.439 0.637 . . . . 1.05 111.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.6 m -130.79 -90.39 0.45 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.341 -0.845 . . . . 1.78 111.351 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -125.08 -62.13 1.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.086 0.402 . . . . 2.39 112.086 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -61.75 -45.63 95.86 Favored Glycine 0 N--CA 1.453 -0.168 0 C-N-CA 121.101 -0.571 . . . . 0.93 113.109 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.601 ' O ' HG12 ' A' ' 32' ' ' VAL . 11.7 m-20 -72.49 -32.61 66.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.22 0.533 . . . . 2.25 110.276 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.574 ' CE ' ' HB3' ' A' ' 25' ' ' LEU . 1.1 tppp? -55.54 -34.84 65.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 1.31 111.049 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.6 m -51.99 -41.87 62.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.128 -0.942 . . . . 0.8 112.292 176.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.601 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -86.68 -24.2 6.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.464 -0.335 . . . . 0.85 111.49 -171.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.548 HD12 ' HE1' ' A' ' 37' ' ' PHE . 4.3 mm? -49.92 -53.08 28.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.789 0.328 . . . . 0.98 111.873 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -64.06 -21.08 66.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 2.41 111.373 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -76.66 -22.08 54.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.19 -0.459 . . . . 1.96 110.829 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.592 HG12 ' OH ' ' A' ' 42' ' ' TYR . 87.6 t -91.84 -52.3 10.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.578 0.704 . . . . 0.98 110.189 177.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.548 ' HE1' HD12 ' A' ' 33' ' ' LEU . 64.8 m-85 -58.24 -39.58 79.5 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.941 1.089 . . . . 0.83 113.941 177.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -85.07 16.89 3.2 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.847 -0.741 . . . . 2.18 110.862 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.78 21.0 11.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.557 -0.747 . . . . 1.56 109.945 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.77 -153.91 9.95 Favored Glycine 0 N--CA 1.452 -0.242 0 N-CA-C 111.32 -0.712 . . . . 1.54 111.32 174.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -83.52 150.64 65.58 Favored 'Cis proline' 0 C--N 1.344 0.318 0 CA-C-N 119.331 1.565 . . . . 1.68 112.761 -2.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.592 ' OH ' HG12 ' A' ' 36' ' ' VAL . 13.7 m-85 -86.5 134.14 33.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.915 -0.584 . . . . 1.28 110.011 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -89.27 -17.36 29.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.315 -0.857 . . . . 3.51 109.219 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.46 HD21 ' HG3' ' A' ' 47' ' ' GLU . 4.8 p30 -145.99 163.37 35.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.28 -0.873 . . . . 1.52 110.011 -177.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.0 m -65.55 -41.81 92.58 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 1.18 111.436 -177.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -55.7 -34.92 65.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 2.24 112.534 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.46 ' HG3' HD21 ' A' ' 44' ' ' ASN . 31.6 mt-10 -56.76 -39.49 74.13 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.034 0.383 . . . . 2.26 112.034 -177.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.2 t -69.04 -43.87 73.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.958 0.409 . . . . 1.19 109.931 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.1 mt -64.52 -44.11 96.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.692 -0.686 . . . . 0.55 110.375 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.29 79.5 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.141 -0.936 . . . . 0.57 112.069 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.424 ' CB ' HG13 ' A' ' 36' ' ' VAL . . . -64.99 -34.76 79.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.937 0.399 . . . . 0.5 110.81 -177.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 16.9 mt -69.49 -32.2 70.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.912 -0.586 . . . . 0.45 111.318 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -67.44 -40.73 85.44 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.836 -0.346 . . . . 1.22 111.188 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -66.4 -28.51 68.68 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.223 0.535 . . . . 3.05 110.869 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.537 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 40.3 mmtt -85.69 -44.12 12.83 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.892 -0.595 . . . . 1.48 112.043 176.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -151.5 103.93 2.91 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 120.712 -0.395 . . . . 1.16 111.361 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -41.31 -62.69 0.37 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 123.87 3.047 . . . . 0.58 113.485 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.36 -29.24 69.94 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.801 -1.09 . . . . 2.45 111.387 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tt -73.22 -42.18 62.91 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.407 -0.96 . . . . 1.42 108.407 -176.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.414 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -65.45 -25.6 71.44 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 114.353 -1.294 . . . . 0.37 111.467 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.78 -32.03 63.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.938 0.399 . . . . 0.48 110.444 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -67.7 -37.99 83.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.282 -0.417 . . . . 2.17 111.178 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.0 p -80.13 -29.56 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.176 0.512 . . . . 1.12 110.061 175.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.15 -48.91 79.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.86 -0.609 . . . . 1.7 110.782 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.17 -30.57 71.16 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 121.397 0.617 . . . . 3.96 109.432 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -73.33 -3.85 29.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.075 -0.966 . . . . 1.5 111.872 -178.17 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -122.13 -29.68 4.17 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.126 -0.63 . . . . 2.34 110.487 171.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.37 -47.34 64.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.659 0.244 . . . . 0.4 111.659 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 35.7 mtm -62.63 -39.33 93.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.747 0.784 . . . . 0.72 109.484 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.437 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 97.0 t -69.55 -35.49 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 114.709 -1.132 . . . . 0.79 110.583 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.12 -39.65 90.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.947 -0.57 . . . . 1.47 110.568 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -55.44 -36.5 66.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.413 0.625 . . . . 1.26 110.371 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 43.7 mttp -77.69 -54.25 6.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.996 -1.002 . . . . 1.54 110.118 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.41 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.6 mt -61.76 -23.2 30.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.34 111.361 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.82 65.5 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.66 -0.7 . . . . 0.35 109.856 177.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.85 -2.98 52.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.813 -1.085 . . . . 0.49 110.016 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.447 HD13 ' HB2' ' A' ' 135' ' ' GLN . 6.8 tp -91.23 135.46 33.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.001 -0.999 . . . . 0.71 109.58 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.68 159.75 48.24 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.803 -0.713 . . . . 0.76 111.829 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -47.73 -38.22 29.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.304 2.669 . . . . 1.56 113.227 -177.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -63.53 -47.73 80.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.343 -0.39 . . . . 2.52 111.228 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -87.05 -29.79 21.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.104 -0.498 . . . . 0.36 111.419 -174.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.41 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.0 ttpt -57.87 -41.74 83.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.09 -0.505 . . . . 2.04 111.319 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.09 -41.26 96.45 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.564 -0.826 . . . . 0.41 112.083 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -71.57 -41.56 68.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.801 -0.2 . . . . 1.65 111.057 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -57.81 -49.57 76.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.871 0.367 . . . . 0.41 111.666 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.93 -29.3 69.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.353 -0.385 . . . . 1.96 111.522 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.4 OUTLIER -88.42 -38.29 15.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 111.743 0.275 . . . . 2.12 111.743 -176.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.5 p -60.3 -39.8 88.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.101 0.477 . . . . 0.57 109.769 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -63.82 -41.32 92.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.681 -0.69 . . . . 1.09 110.879 175.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 8.0 pt-20 -67.16 -32.72 74.01 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.837 -0.345 . . . . 2.82 110.736 -177.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 87' ' ' LYS . 74.3 mt -73.23 -52.31 22.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.82 0.343 . . . . 0.51 110.546 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.8 -43.34 98.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.076 -0.511 . . . . 0.64 111.206 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 12.3 ptt180 -66.3 -23.38 66.37 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.132 -0.485 . . . . 4.42 110.454 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.0 -41.33 55.0 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.005 -0.617 . . . . 0.66 112.137 -179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.0 mm -65.61 -44.39 93.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.818 0.818 . . . . 0.55 109.125 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.4 ' HD2' HD12 ' A' ' 22' ' ' LEU . 14.8 ttpp -88.45 29.03 1.02 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.673 -1.148 . . . . 2.7 109.887 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 93' ' ' ARG . . . -121.75 -34.48 3.39 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.113 -0.949 . . . . 0.63 110.567 168.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.626 ' O ' ' HB3' ' A' ' 103' ' ' ASN . 17.1 ptm180 -80.88 0.07 36.81 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 120.194 -0.602 . . . . 3.1 109.498 176.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.475 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 5.6 m-85 -81.27 -28.78 34.56 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.024 -0.361 . . . . 0.97 110.024 165.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.523 ' CE1' HD21 ' A' ' 22' ' ' LEU . 30.9 m-85 -72.44 -34.18 67.59 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.963 0.411 . . . . 1.48 111.272 -178.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.4 p -73.53 -12.08 60.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.659 -0.701 . . . . 0.87 112.554 -173.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.78 55.08 Favored Glycine 0 N--CA 1.453 -0.232 0 N-CA-C 111.103 -0.799 . . . . 1.16 111.103 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 98' ' ' ARG . 40.6 t-20 -87.89 162.3 17.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.038 -1.097 . . . . 1.83 108.038 176.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.401 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 20.6 mt-10 -139.46 97.92 8.26 Favored Pre-proline 0 C--N 1.32 -0.705 0 O-C-N 122.114 -0.366 . . . . 1.75 110.84 -178.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.7 Cg_endo -57.05 139.89 91.17 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.443 2.095 . . . . 0.53 111.634 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.3 t -78.55 165.98 23.1 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.49 -0.559 . . . . 1.48 109.49 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.1 pttp -58.0 -33.78 69.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.279 0.561 . . . . 2.88 110.373 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.97 -25.92 65.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.438 -0.801 . . . . 2.24 111.015 -179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -67.81 -45.24 75.3 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.364 -0.606 . . . . 1.73 109.364 176.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.1 mp -63.77 -44.99 91.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.372 -0.831 . . . . 0.82 110.4 177.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 30.1 mtpp -56.29 -42.41 77.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 1.74 110.432 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.26 77.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.572 -0.74 . . . . 0.47 111.596 177.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.1 p -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.169 0.433 . . . . 1.34 112.169 -177.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.916 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.4 m -77.73 -23.67 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.828 0.823 . . . . 0.65 109.598 -177.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -67.19 -39.46 86.39 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.093 -0.958 . . . . 1.72 111.26 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 14.1 mm-40 -71.45 -34.32 70.13 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.463 -0.495 . . . . 2.27 110.772 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -65.78 -33.55 64.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.377 -0.529 . . . . 0.81 109.932 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' A' ' 149' ' ' ALA . 62.8 mt -72.18 -33.94 68.06 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.76 -0.459 . . . . 1.21 109.76 174.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.1 ttpt -56.93 -44.24 82.3 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.891 -0.781 . . . . 0.95 108.891 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.4 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.6 mp -70.91 -48.52 53.18 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.872 -1.058 . . . . 1.06 111.467 174.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 129' ' ' LYS . 51.0 t80 -71.24 -30.87 66.86 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 119.498 -0.881 . . . . 1.54 111.526 -167.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -66.84 -35.05 79.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.032 0.444 . . . . 1.98 110.793 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -88.58 -10.21 49.54 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.88 0.696 . . . . 0.7 112.88 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.5 mtm -71.15 156.36 39.67 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.837 -0.345 . . . . 0.5 111.692 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.434 ' O ' ' HG2' ' A' ' 129' ' ' LYS . 46.8 t -53.2 141.15 24.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.001 -0.545 . . . . 1.18 110.155 173.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.37 -48.9 77.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.816 0.341 . . . . 2.21 110.924 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.66 75.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.541 . . . . 0.42 110.815 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -73.13 -44.59 35.0 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.751 -0.659 . . . . 0.31 112.607 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 121' ' ' TYR . 14.1 ptmm? -71.15 -29.08 64.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.989 0.423 . . . . 1.32 110.918 -177.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.37 65.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.42 110.985 174.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.33 -27.91 67.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.296 0.57 . . . . 0.55 109.702 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.49 -25.21 67.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.224 -0.898 . . . . 0.39 110.529 174.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.501 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -75.07 -12.48 83.39 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.891 -0.671 . . . . 0.27 113.344 -177.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -90.52 -48.23 7.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.434 0.635 . . . . 2.43 110.01 -178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.447 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -79.8 -31.97 40.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.115 -0.948 . . . . 1.83 110.732 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.437 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 5.9 m-85 -124.75 74.64 64.36 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.786 0.327 . . . . 0.69 110.755 175.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.14 -33.97 23.49 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.954 2.436 . . . . 0.63 112.948 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 37.3 t80 -73.93 -42.38 60.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.724 0.297 . . . . 2.31 110.718 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.556 HD21 ' HD3' ' A' ' 15' ' ' PRO . 58.2 mt -70.92 -44.27 66.53 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.942 -0.303 . . . . 1.02 110.624 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.501 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -59.36 -39.42 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.35 110.148 178.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.2 tttm -46.12 -65.75 0.5 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.315 -0.857 . . . . 2.58 111.456 172.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.19 -18.59 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.391 -0.822 . . . . 0.5 112.883 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 18.6 m-85 -81.75 -41.99 20.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.103 -0.639 . . . . 0.62 110.933 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -70.32 -39.17 74.92 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.115 0.483 . . . . 2.58 110.6 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.0 t -83.95 161.66 20.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.615 -0.721 . . . . 1.32 109.306 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.67 57.74 3.82 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.626 -0.797 . . . . 1.09 112.678 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -106.55 -69.18 0.84 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.798 -0.445 . . . . 1.98 109.798 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.04 -40.69 87.23 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.057 0.456 . . . . 0.34 109.783 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -56.99 -43.52 81.78 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.521 -0.763 . . . . 0.51 110.652 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.02 -38.56 86.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.052 0.453 . . . . 2.82 110.413 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -67.52 -34.37 76.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.615 -0.72 . . . . 0.49 111.305 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.916 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -89.37 -37.26 14.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.933 0.716 . . . . 0.59 112.933 -174.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.472 0 N-CA-C 110.814 -0.914 . . . . 1.62 110.814 -169.839 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.7 p90 . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.104 0.478 . . . . 1.47 110.483 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HB3' ' OD1' ' A' ' 5' ' ' ASP . 75.3 tttt -135.62 158.1 45.23 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.043 -0.725 . . . . 3.15 109.043 170.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -49.27 -51.52 33.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.167 0.508 . . . . 2.35 110.288 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.32 -20.34 66.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.245 -0.889 . . . . 4.16 112.405 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.537 ' OD1' ' HB3' ' A' ' 2' ' ' LYS . 2.6 m-20 -88.58 -18.8 27.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.865 0.364 . . . . 2.57 110.971 -175.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.2 mt -72.86 131.25 84.19 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.795 -0.817 . . . . 0.69 108.795 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -41.33 113.28 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.217 2.611 . . . . 0.6 112.163 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -19.65 65.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.798 . . . . 0.57 112.218 -171.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.44 -33.47 76.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.773 0.797 . . . . 1.37 109.372 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.81 -37.29 22.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.201 -1.363 . . . . 0.8 111.502 -175.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -66.13 -31.87 72.99 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.798 -0.815 . . . . 1.73 108.798 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -15.29 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.042 -1.435 . . . . 1.02 111.908 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.4 mt -92.28 -33.95 14.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.721 0.296 . . . . 0.93 110.688 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.518 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 70.3 mtm -70.19 142.56 90.09 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 1.15 111.191 -176.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.65 149.13 60.75 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.65 2.234 . . . . 0.9 111.906 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -44.37 -49.39 8.98 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.866 3.044 . . . . 0.96 113.599 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' HD21 ' A' ' 66' ' ' LEU . 46.5 mt-10 -59.05 -43.25 91.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.688 0.28 . . . . 1.83 111.703 -176.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.83 -7.12 49.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.82 111.227 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.518 ' HD2' ' O ' ' A' ' 14' ' ' MET . 62.2 mtp180 -101.01 -32.54 10.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.85 -0.614 . . . . 2.16 110.189 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.81 -46.31 50.91 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.854 -0.612 . . . . 1.06 111.392 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 25' ' ' LEU . 58.0 t80 -56.24 -56.59 19.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.965 -0.561 . . . . 0.65 111.526 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -78.66 -7.52 57.75 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.609 1.095 . . . . 1.13 111.984 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -70.97 -32.86 69.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.93 0.395 . . . . 2.06 110.152 164.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -82.67 -49.6 9.62 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.737 -0.665 . . . . 1.84 112.244 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 21' ' ' PHE . 2.9 mm? -52.26 134.15 33.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.382 0.61 . . . . 1.05 111.005 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.1 t -130.01 -69.55 0.67 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.444 -0.798 . . . . 1.78 111.289 -174.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -141.24 -78.07 0.28 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.193 0.442 . . . . 2.39 112.193 -172.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.405 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -62.75 -30.84 78.19 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.93 112.594 -174.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -66.9 -51.69 52.3 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.636 -0.282 . . . . 2.25 110.898 176.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 87.7 mttt -56.87 -27.31 60.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.116 0.484 . . . . 1.31 110.886 176.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 45.3 m -65.2 -26.92 68.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.774 . . . . 0.8 110.717 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.9 p -98.27 -23.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 120.64 -0.424 . . . . 0.85 110.808 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.402 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -54.07 -50.36 66.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.74 -0.209 . . . . 0.98 111.14 171.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 0.0 OUTLIER -64.97 -25.48 67.89 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.726 0.298 . . . . 2.41 111.712 -177.204 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 9.0 mm-40 -68.97 -39.12 79.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.348 -0.387 . . . . 1.96 110.281 175.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.75 -50.66 42.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.936 -0.574 . . . . 0.98 110.379 178.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.406 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 20.4 m-85 -54.6 -46.45 73.8 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 114.066 1.135 . . . . 0.83 114.066 177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -84.6 7.86 18.74 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.662 -0.815 . . . . 2.18 111.201 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.27 12.24 32.03 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.087 -0.709 . . . . 1.56 109.087 171.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -97.27 -152.26 28.45 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.209 -0.905 . . . . 1.54 111.242 175.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.74 153.65 95.54 Favored 'Cis proline' 0 C--N 1.344 0.3 0 CA-C-N 119.088 1.444 . . . . 1.68 112.655 -0.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.574 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 98.6 m-85 -103.83 140.65 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.86 -0.609 . . . . 1.28 110.095 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -76.58 -15.73 59.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.464 -0.789 . . . . 3.51 110.239 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.94 148.08 25.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.713 -0.676 . . . . 1.52 110.327 -177.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.8 t -68.91 -18.66 64.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.074 -0.512 . . . . 1.18 111.525 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -57.12 -46.35 82.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.902 0.382 . . . . 2.24 110.739 176.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.574 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.2 OUTLIER -63.6 -29.74 70.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.038 -0.528 . . . . 2.26 111.367 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.0 t -72.43 -42.1 65.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.722 -0.473 . . . . 1.19 109.722 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.84 -46.36 88.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.776 -0.647 . . . . 0.55 110.205 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.42 -49.51 67.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.182 -0.917 . . . . 0.57 111.673 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.79 82.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.183 0.516 . . . . 0.5 110.788 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.402 HD21 HD13 ' A' ' 33' ' ' LEU . 48.1 mt -69.73 -37.06 76.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 0.45 111.086 -179.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -62.91 -38.74 92.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.915 0.388 . . . . 1.22 111.67 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.154 0.502 . . . . 3.05 110.988 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 22.6 mmtt -77.41 -46.49 22.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.827 -0.624 . . . . 1.48 111.852 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.47 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 68.6 m -146.11 97.01 4.52 Favored Pre-proline 0 C--N 1.315 -0.918 0 N-CA-C 110.108 -0.33 . . . . 1.16 110.108 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 5.7 Cg_endo -47.5 -62.94 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.855 3.036 . . . . 0.58 113.553 -167.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 11.2 pt-20 -67.14 -25.55 66.24 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.162 -0.926 . . . . 2.45 111.749 -177.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 59' ' ' LEU . 2.0 tm? -74.29 -41.67 60.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.529 -0.915 . . . . 1.42 108.529 -177.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.9 -23.71 77.75 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 114.596 -1.183 . . . . 0.37 111.639 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.28 -32.51 71.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.804 0.335 . . . . 0.48 110.454 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 67.9 mttm -64.93 -49.85 68.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 2.17 110.766 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.27 -29.9 48.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.925 0.393 . . . . 1.12 110.348 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.79 -61.66 2.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.539 . . . . 1.7 111.002 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.9 mptt -59.78 -37.07 78.06 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.11 0.481 . . . . 3.96 110.596 -174.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.3 tm? -64.61 -43.7 92.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.123 -0.944 . . . . 1.5 110.278 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 t60 -78.82 -32.97 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.321 -0.622 . . . . 2.34 109.321 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.51 98.59 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.12 -0.946 . . . . 0.4 111.832 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 61.5 mtm -59.83 -51.08 71.27 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.411 0.624 . . . . 0.72 110.06 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 66' ' ' LEU . 97.1 t -57.02 -43.58 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 114.786 -1.097 . . . . 0.79 110.687 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.4 mmmt -61.12 -38.84 87.8 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.92 -0.582 . . . . 1.47 111.386 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -63.17 -37.22 86.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.26 0.553 . . . . 1.26 110.801 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.35 -43.37 64.15 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 1.54 110.416 177.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 72.0 mt -67.99 -22.5 27.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.477 0.656 . . . . 0.34 110.245 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.04 -36.25 72.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.931 0.872 . . . . 0.35 109.851 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.01 -2.08 55.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.301 -1.318 . . . . 0.49 110.27 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 8.5 tp -92.01 137.03 32.7 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.71 109.605 -176.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.39 156.66 52.21 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.755 -0.736 . . . . 0.76 111.964 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -44.29 -41.43 13.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.86 3.04 . . . . 1.56 114.235 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -67.43 -50.22 60.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.71 0.291 . . . . 2.52 110.76 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -76.24 -31.35 58.31 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.258 -0.577 . . . . 0.36 110.297 -176.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 40.7 ttmt -58.35 -45.58 87.92 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.475 -0.784 . . . . 2.04 111.187 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.12 -40.85 96.17 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.899 -0.667 . . . . 0.41 112.177 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.5 t80 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.99 -0.105 . . . . 1.65 111.278 177.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -55.51 -44.92 77.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.95 0.405 . . . . 0.41 111.657 -175.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 40.6 mt-10 -71.19 -22.26 62.04 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.544 -0.462 . . . . 1.96 110.846 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -79.5 -40.3 30.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.619 -0.264 . . . . 2.12 111.249 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.3 p -61.78 -27.04 68.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.061 0.457 . . . . 0.57 110.3 176.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -74.34 -50.51 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.918 -0.583 . . . . 1.09 110.132 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 42.1 mt-10 -58.23 -53.64 55.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.191 0.441 . . . . 2.82 112.191 -177.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.72 -45.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.276 -0.42 . . . . 0.51 111.218 -174.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.523 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.63 -40.88 84.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.64 110.872 179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -63.5 -31.05 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.87 -0.605 . . . . 4.42 110.673 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.14 -36.15 89.82 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.782 -0.723 . . . . 0.66 111.896 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.436 HG13 ' CB ' ' A' ' 113' ' ' SER . 43.9 mm -67.66 -50.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.058 0.456 . . . . 0.55 110.42 178.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 39.4 pttt -82.12 0.19 41.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.159 -0.473 . . . . 2.7 111.646 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.52 -27.99 60.78 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.127 -0.694 . . . . 0.63 109.127 164.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.503 ' HA ' ' HG1' ' A' ' 101' ' ' THR . 66.6 mtp180 -86.69 -7.61 58.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.679 -0.691 . . . . 3.1 109.579 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -81.89 -41.36 21.05 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.349 -0.611 . . . . 0.97 109.349 167.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 32.5 m-85 -63.39 -50.11 71.16 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.201 0.524 . . . . 1.48 110.981 178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.503 ' HG1' ' HA ' ' A' ' 98' ' ' ARG . 17.5 p -66.78 -14.43 62.6 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.321 0.86 . . . . 0.87 113.321 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 94.13 3.43 63.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.689 -0.767 . . . . 1.16 113.184 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 37.0 m-80 -98.51 68.31 1.83 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.2 -0.296 . . . . 1.83 110.2 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -52.31 119.65 15.47 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.709 -0.678 . . . . 1.75 112.318 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.22 163.38 38.86 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.589 2.859 . . . . 0.53 112.722 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 67.3 p -85.77 173.52 9.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.116 -0.493 . . . . 1.48 109.865 174.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -66.59 -27.83 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.19 -0.67 . . . . 2.88 109.19 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.43 -40.23 93.66 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.286 -0.87 . . . . 2.24 110.782 177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -59.04 -44.71 91.8 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.876 0.37 . . . . 1.73 110.588 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.561 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -67.66 -46.13 73.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.82 110.835 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.435 ' O ' HG22 ' A' ' 114' ' ' VAL . 61.8 mtpt -55.77 -45.86 78.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.261 0.553 . . . . 1.74 110.101 177.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -62.07 -43.5 98.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.441 -0.799 . . . . 0.47 111.692 178.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.436 ' CB ' HG13 ' A' ' 95' ' ' ILE . 57.9 p -64.92 -36.2 83.6 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.002 0.371 . . . . 1.34 112.002 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.797 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -78.62 -25.12 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 109.024 -0.732 . . . . 0.65 109.024 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 45.5 mttm -61.53 -45.81 92.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.221 -0.899 . . . . 1.72 111.408 176.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.625 ' O ' HD13 ' A' ' 120' ' ' LEU . 22.3 mm-40 -71.01 -38.7 72.63 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.582 -0.447 . . . . 2.27 110.457 -174.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.523 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.9 m -62.85 -38.5 82.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.483 -0.487 . . . . 0.81 110.265 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.615 HD13 ' HA ' ' A' ' 149' ' ' ALA . 41.2 mt -78.49 -26.68 46.05 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.079 -0.388 . . . . 1.21 111.358 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -61.98 -48.54 79.88 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.525 -0.917 . . . . 0.95 108.525 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -65.78 -43.82 87.62 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.072 -1.422 . . . . 1.06 111.667 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.472 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 47.7 t80 -72.03 -37.52 69.73 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 120.315 -0.554 . . . . 1.54 111.291 -170.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' A' ' 118' ' ' LEU . 5.8 mptp? -59.75 -31.97 70.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.47 . . . . 1.98 111.052 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.44 -5.68 59.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.593 -0.731 . . . . 0.7 112.608 -174.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -77.39 156.69 31.02 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.048 -0.661 . . . . 0.5 110.389 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.7 t -67.23 152.05 46.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.639 -0.504 . . . . 1.18 109.639 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -54.72 -42.42 71.5 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.814 0.34 . . . . 2.21 111.254 -175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.04 -30.39 71.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.42 111.044 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.92 -37.46 50.49 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.217 -0.753 . . . . 0.31 111.217 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -63.08 -45.63 91.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.195 0.521 . . . . 1.32 109.986 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.59 84.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.426 -0.807 . . . . 0.42 111.41 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 134' ' ' LYS . 24.7 t70 -73.84 -30.63 62.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.292 0.567 . . . . 0.55 109.774 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -64.52 -26.07 68.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.008 -0.542 . . . . 0.39 110.228 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.46 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.96 -14.8 79.99 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 114.243 0.457 . . . . 0.27 114.243 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -95.53 -34.18 12.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.518 0.659 . . . . 2.43 111.408 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -89.64 -28.73 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.768 -0.651 . . . . 1.83 110.695 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -128.9 72.96 81.74 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.296 -0.411 . . . . 0.69 110.168 172.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -61.2 -44.76 22.05 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.832 2.355 . . . . 0.63 112.922 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.527 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 34.8 t80 -66.87 -35.6 80.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 2.31 111.263 -174.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 56.9 mt -74.01 -44.06 55.82 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.614 -0.434 . . . . 1.02 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.46 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -61.15 -32.72 72.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.409 0.623 . . . . 0.35 110.065 176.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.2 tttm -55.18 -70.84 0.09 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.926 -1.034 . . . . 2.58 110.963 171.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.487 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.9 m -60.37 -30.29 46.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 112.966 0.728 . . . . 0.5 112.966 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.28 -54.4 14.87 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.248 -0.581 . . . . 0.62 110.657 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -79.22 -19.19 51.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 2.58 112.088 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.1 t -85.48 3.45 40.24 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.992 0.425 . . . . 1.32 110.58 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 149' ' ' ALA . . . 75.54 16.83 80.39 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.803 -0.713 . . . . 1.09 112.804 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -79.45 -62.38 1.71 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.836 0.351 . . . . 1.98 110.112 -178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -70.75 -37.14 73.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.094 -0.503 . . . . 0.34 110.006 176.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.615 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -54.56 -37.45 65.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.284 -0.871 . . . . 0.51 111.82 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 150' ' ' LYS . 45.3 tptt -82.8 -23.79 33.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.902 0.382 . . . . 2.82 110.697 -177.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.42 ' HD2' HG21 ' A' ' 114' ' ' VAL . 50.2 t80 -72.48 -29.16 63.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 0.49 109.823 174.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.797 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.62 -35.08 19.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.903 -0.589 . . . . 0.59 110.826 176.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 110.533 -1.027 . . . . 1.62 110.533 -172.355 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 24.1 p90 . . . . . 0 C--O 1.233 0.227 0 CA-C-O 121.148 0.499 . . . . 1.47 110.855 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -105.48 136.12 45.63 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.376 -0.601 . . . . 3.15 109.376 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -65.23 -35.27 80.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.85 0.357 . . . . 2.35 110.737 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -73.1 -5.75 41.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.451 -0.34 . . . . 4.16 111.753 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -87.92 -10.93 49.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.401 0.619 . . . . 2.57 109.848 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 68.1 mt -79.31 134.69 58.42 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.499 -0.926 . . . . 0.69 108.499 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -41.78 113.58 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.184 2.589 . . . . 0.6 112.123 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -17.99 65.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.723 -0.671 . . . . 0.57 111.768 -172.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 7.4 m-20 -65.27 -31.21 72.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.936 0.874 . . . . 1.37 109.426 178.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 75.0 t80 -85.06 -28.89 25.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.036 -1.438 . . . . 0.8 110.313 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.495 ' HA ' ' HG2' ' A' ' 14' ' ' MET . 58.7 mtp180 -72.02 -25.05 61.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.84 0.829 . . . . 1.73 108.849 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -71.53 -18.99 62.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.172 -1.376 . . . . 1.02 110.661 174.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 9' ' ' ASP . 72.1 mt -91.39 -48.48 6.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.93 111.124 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.495 ' HG2' ' HA ' ' A' ' 11' ' ' ARG . 17.5 ptp -63.23 133.38 95.43 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 120.979 0.419 . . . . 1.15 109.994 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD3' HD21 ' A' ' 139' ' ' LEU . 65.8 Cg_endo -74.26 163.81 35.61 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.602 2.201 . . . . 0.9 112.385 -175.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -43.83 -41.74 11.88 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.93 2.42 . . . . 0.96 112.697 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.7 -34.5 18.87 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.438 -0.801 . . . . 1.83 112.122 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.53 -19.25 19.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.717 0.294 . . . . 0.82 111.25 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.455 ' HG2' ' SD ' ' A' ' 14' ' ' MET . 19.0 mtm180 -88.46 -42.48 12.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.382 -0.372 . . . . 2.16 111.393 -176.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.54 -40.74 60.25 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 123.242 0.339 . . . . 1.06 111.832 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.609 ' O ' HD23 ' A' ' 25' ' ' LEU . 32.5 t80 -61.34 -58.97 6.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 119.005 -0.522 . . . . 0.65 111.332 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.418 HD11 ' HE1' ' A' ' 100' ' ' TYR . 32.5 mt -73.41 -11.92 60.64 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.814 1.188 . . . . 1.13 112.192 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -39.29 83.79 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.622 -0.51 . . . . 2.06 109.622 164.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -69.96 -50.43 41.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.866 -0.607 . . . . 1.84 111.109 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.609 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -59.32 141.97 53.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.31 0.576 . . . . 1.05 111.289 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -141.26 -83.03 0.21 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.491 -0.777 . . . . 1.78 110.456 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.93 158.73 43.8 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.999 -0.741 . . . . 2.39 108.999 176.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.52 -51.4 3.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.894 -0.67 . . . . 0.93 112.833 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 7.8 m-20 -68.75 -43.89 74.87 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.787 -0.243 . . . . 2.25 111.14 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.47 -20.03 62.69 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.0 0.429 . . . . 1.31 111.031 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.3 m -63.74 -39.98 95.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.8 110.975 177.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.7 p -80.85 -27.04 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 116.186 -0.461 . . . . 0.85 110.34 -176.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.572 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.4 mm? -54.49 -56.41 19.11 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.279 -0.419 . . . . 0.98 111.329 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -60.93 -25.23 66.63 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.921 0.341 . . . . 2.41 111.921 -175.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -74.19 -15.4 61.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.969 0.414 . . . . 1.96 111.339 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 82.6 t -90.38 -48.1 14.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.575 0.702 . . . . 0.98 109.317 173.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.572 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 52.6 m-85 -55.1 -45.09 75.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.637 -1.165 . . . . 0.83 114.018 176.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.12 14.15 5.41 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.952 -0.699 . . . . 2.18 111.557 -176.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.51 -77.25 0.59 Allowed 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.556 -0.747 . . . . 1.56 109.846 173.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.508 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 45.82 -150.72 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.795 -0.716 . . . . 1.54 112.684 -174.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.3 Cg_endo -91.84 148.99 16.0 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.096 -1.21 . . . . 1.68 111.06 -9.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.508 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 23.4 m-85 -116.79 122.13 43.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.457 0.646 . . . . 1.28 111.067 -171.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.592 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 6.9 ptpp? -88.39 -7.02 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.91 -1.041 . . . . 3.51 109.948 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.586 HD21 ' HG3' ' A' ' 47' ' ' GLU . 8.2 p30 -151.83 162.63 40.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.67 -0.696 . . . . 1.52 109.654 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 25.9 m -69.38 -32.66 71.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.392 -0.367 . . . . 1.18 111.19 -177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 46.3 mt-10 -59.59 -38.33 80.94 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.073 -0.512 . . . . 2.24 111.313 -176.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.592 ' OE1' ' HG2' ' A' ' 43' ' ' LYS . 34.0 mt-10 -57.87 -42.76 85.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.955 0.407 . . . . 2.26 111.403 177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -70.99 -37.48 72.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.141 -0.481 . . . . 1.19 110.148 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 45' ' ' THR . 69.9 mt -65.98 -42.65 92.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.088 -0.505 . . . . 0.55 110.093 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.02 75.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.339 -0.846 . . . . 0.57 111.025 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.49 90.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.871 -0.604 . . . . 0.5 110.396 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.552 HD21 HD13 ' A' ' 33' ' ' LEU . 24.9 mt -67.23 -40.76 86.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.135 -0.939 . . . . 0.45 111.174 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.51 -32.68 72.72 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.809 0.338 . . . . 1.22 111.004 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -77.27 -46.8 21.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 3.05 110.596 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.511 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.1 mmtt -68.52 -49.46 59.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.024 -0.535 . . . . 1.48 111.858 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 m -147.5 92.26 4.85 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 109.853 -0.425 . . . . 1.16 109.853 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -37.39 -56.75 0.8 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 124.593 3.529 . . . . 0.58 114.096 -172.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.68 -28.89 69.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.409 -0.814 . . . . 2.45 112.148 -175.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 33.8 mt -72.63 -37.9 67.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.755 0.788 . . . . 1.42 109.022 -178.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.27 -36.41 89.6 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 114.526 -1.215 . . . . 0.37 111.229 174.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.595 ' O ' ' HD3' ' A' ' 65' ' ' LYS . . . -61.15 -41.19 96.31 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.348 -0.241 . . . . 0.48 110.348 174.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 42.6 mmtm -50.89 -63.65 1.06 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.261 0.553 . . . . 2.17 110.375 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.2 m -67.49 -27.69 39.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.048 -0.978 . . . . 1.12 111.747 -172.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.15 -45.85 79.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.826 0.346 . . . . 1.7 111.193 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -76.62 -34.88 58.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.742 0.782 . . . . 3.96 109.448 179.184 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.44 -48.11 68.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.593 -1.185 . . . . 1.5 112.047 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -72.93 -25.92 61.21 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.842 -0.799 . . . . 2.34 108.842 -175.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.84 -35.3 80.28 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 114.68 -1.146 . . . . 0.4 111.225 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.4 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 36.4 mtm -62.48 -49.96 73.31 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.139 -0.689 . . . . 0.72 109.139 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.424 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 67.4 t -54.22 -48.81 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 114.707 -1.133 . . . . 0.79 110.268 176.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -63.6 -43.08 97.98 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.485 -0.78 . . . . 1.47 112.403 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.5 m -64.88 -30.53 71.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.855 0.359 . . . . 1.26 111.303 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.5 mtmt -77.79 -36.26 50.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.428 -0.351 . . . . 1.54 110.232 176.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.89 -24.83 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.505 0.669 . . . . 0.34 110.319 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.92 70.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.804 0.811 . . . . 0.35 109.798 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.47 -0.63 57.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.562 -1.199 . . . . 0.49 110.709 -179.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.3 tp -94.79 135.48 36.23 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.851 -0.613 . . . . 0.71 109.944 -178.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.44 144.43 48.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.929 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -33.8 -43.3 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 125.067 3.845 . . . . 1.56 115.199 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -64.76 -52.73 55.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.941 0.4 . . . . 2.52 110.591 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.5 -31.55 53.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.41 0.624 . . . . 0.36 109.946 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -57.84 -46.26 85.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.772 -1.104 . . . . 2.04 111.118 176.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.91 -40.2 98.54 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.648 -0.787 . . . . 0.41 111.574 177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -65.3 -46.57 79.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.603 -0.299 . . . . 1.65 110.804 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.35 -46.0 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.039 0.447 . . . . 0.41 111.198 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -60.04 -38.42 82.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.3 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.443 ' HD2' HD11 ' A' ' 91' ' ' ILE . 4.3 tmtp? -77.61 -46.45 22.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.123 -0.231 . . . . 2.12 110.65 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 p -63.37 -43.05 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.753 0.311 . . . . 0.57 111.165 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -62.03 -40.36 87.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 1.09 110.354 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -66.76 -35.52 80.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.493 -0.321 . . . . 2.82 111.42 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.443 HD11 ' HD2' ' A' ' 87' ' ' LYS . 94.8 mt -63.87 -45.72 96.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.723 0.297 . . . . 0.51 110.513 177.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.683 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -64.95 -42.44 94.62 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.697 -0.482 . . . . 0.64 109.697 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -59.48 -34.06 72.09 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.556 -0.747 . . . . 4.42 111.265 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.69 -39.55 86.13 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.958 -0.639 . . . . 0.66 112.287 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.467 HD11 ' OG ' ' A' ' 113' ' ' SER . 29.6 mm -66.45 -49.67 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.166 0.508 . . . . 0.55 109.672 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.5 ptmm? -83.87 36.01 0.54 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.61 0.719 . . . . 2.7 110.114 175.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.1 -32.92 3.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.949 -1.023 . . . . 0.63 109.842 165.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -88.0 -3.48 58.9 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.137 -0.483 . . . . 3.1 110.315 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 28.2 m-85 -88.32 -31.23 19.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.16 0.505 . . . . 0.97 109.778 166.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.454 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 4.5 m-85 -66.74 -34.57 78.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.722 -0.672 . . . . 1.48 111.765 -176.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 p -73.63 -0.42 15.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.756 -0.657 . . . . 0.87 112.644 -174.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.86 9.48 64.03 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.688 -0.768 . . . . 1.16 111.945 -175.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -105.28 177.3 4.89 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.851 -0.426 . . . . 1.83 109.851 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 56.8 mt-10 -141.59 100.65 6.13 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.611 -0.268 . . . . 1.75 111.396 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.452 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 9.6 Cg_endo -56.96 132.83 54.07 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 121.987 1.791 . . . . 0.53 110.078 167.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -76.03 173.51 11.18 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.313 -0.555 . . . . 1.48 110.157 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 86.0 tttt -60.13 -33.12 71.71 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.767 -0.373 . . . . 2.88 110.366 -175.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -58.32 -40.87 83.2 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.819 -0.628 . . . . 2.24 110.864 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.02 -47.55 84.8 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.124 -0.489 . . . . 1.73 110.544 177.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.498 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.7 mp -65.4 -45.98 81.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.715 -0.675 . . . . 0.82 110.713 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 151' ' ' PHE . 59.9 mtpt -55.16 -51.32 66.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.03 0.443 . . . . 1.74 110.481 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.554 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -60.96 -41.26 96.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.543 -0.753 . . . . 0.47 111.2 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.467 ' OG ' HD11 ' A' ' 95' ' ' ILE . 50.4 m -65.13 -43.08 93.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.216 -0.447 . . . . 1.34 112.04 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.517 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.2 m -76.15 -29.88 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.596 0.712 . . . . 0.65 109.646 -176.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.4 ptmt -72.47 -26.11 61.68 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.13 -0.941 . . . . 1.72 110.624 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.569 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.8 tt0 -76.83 -33.7 57.93 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 109.262 -0.644 . . . . 2.27 109.262 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 114' ' ' VAL . 93.6 t -58.42 -47.72 87.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.424 0.63 . . . . 0.81 110.198 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.582 ' O ' ' HG3' ' A' ' 122' ' ' LYS . 7.7 mt -69.41 -26.14 64.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.62 -0.718 . . . . 1.21 110.37 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 34.3 ttpt -62.62 -43.99 97.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.677 -0.86 . . . . 0.95 108.677 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.77 -45.95 66.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.839 -1.073 . . . . 1.06 111.841 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -36.12 70.99 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 118.929 -1.108 . . . . 1.54 111.833 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 29.8 mttp -64.39 -30.3 71.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.057 0.456 . . . . 1.98 110.49 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -6.38 58.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 0.7 112.352 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.6 mtm -77.37 158.38 30.13 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.224 -0.591 . . . . 0.5 110.317 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.5 m -65.15 152.11 44.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.338 -0.245 . . . . 1.18 110.338 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -57.18 -42.15 80.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.725 0.298 . . . . 2.21 111.181 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.2 -29.65 70.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.42 110.956 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.25 -38.66 53.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.942 -0.572 . . . . 0.31 111.932 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -61.51 -45.54 93.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.474 0.654 . . . . 1.32 109.514 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.18 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.05 -0.977 . . . . 0.42 110.966 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -74.24 -34.35 63.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.047 -0.524 . . . . 0.55 109.669 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.06 -34.03 76.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.722 -0.672 . . . . 0.39 110.098 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.43 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -63.9 -22.3 66.4 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.94 -0.573 . . . . 0.27 113.318 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -85.81 -19.38 30.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 2.43 111.386 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -105.45 -37.2 6.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 1.83 110.991 -177.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.424 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 77.8 m-85 -129.23 73.58 81.59 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.932 0.396 . . . . 0.69 110.059 175.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.47 -30.78 72.08 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.885 2.39 . . . . 0.63 112.388 -175.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 36.2 t80 -69.63 -39.53 77.09 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.439 . . . . 2.31 110.242 -178.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.465 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 71.0 mt -77.62 -44.14 29.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.301 -0.408 . . . . 1.02 110.75 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.43 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.29 -39.03 74.91 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.744 -0.465 . . . . 0.35 109.744 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.571 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.2 tttt -45.62 -71.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.04 -0.982 . . . . 2.58 111.444 171.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -67.06 -25.24 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.489 -0.778 . . . . 0.5 112.706 -172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.465 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 23.0 m-30 -75.03 -54.52 7.02 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.755 -0.778 . . . . 0.62 110.125 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -64.69 -31.3 72.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 2.58 111.777 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 15.7 m -84.9 0.19 51.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.794 0.33 . . . . 1.32 111.471 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.97 79.06 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.774 -0.727 . . . . 1.09 112.648 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -69.43 -47.33 64.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.94 0.4 . . . . 1.98 110.102 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.95 -30.49 61.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.149 -0.478 . . . . 0.34 110.589 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.541 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -58.58 -39.55 80.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.51 111.725 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -79.87 -29.54 40.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.78 -0.368 . . . . 2.82 110.8 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 111' ' ' LYS . 66.7 t80 -66.56 -33.01 74.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.177 0.513 . . . . 0.49 109.656 172.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.517 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -67.74 -25.59 65.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.349 -0.841 . . . . 0.59 111.03 177.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.61 0 CA-C-N 115.558 -0.746 . . . . 1.62 112.013 -179.989 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 p90 . . . . . 0 C--O 1.237 0.421 0 N-CA-C 109.821 -0.437 . . . . 1.47 109.821 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -105.7 149.45 26.37 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.968 -0.382 . . . . 3.15 109.968 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -54.47 -45.55 73.2 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.921 0.391 . . . . 2.35 111.233 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.54 16.34 1.39 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.477 0.547 . . . . 4.16 112.477 -176.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -86.12 -8.56 57.78 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.647 -0.872 . . . . 2.57 108.647 171.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.8 mt -85.62 129.27 55.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.947 -1.024 . . . . 0.69 109.0 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -42.34 114.77 0.42 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.311 2.674 . . . . 0.6 112.442 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.61 -23.96 65.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.82 -0.627 . . . . 0.57 111.928 -174.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.32 -35.94 82.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.724 0.773 . . . . 1.37 110.022 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -82.16 -20.24 38.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.655 -1.157 . . . . 0.8 110.945 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -72.35 -20.24 61.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.266 -0.642 . . . . 1.73 109.266 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.4 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 6.4 t70 -74.71 -23.69 58.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.844 -1.071 . . . . 1.02 109.745 174.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.42 HD11 ' HG2' ' A' ' 147' ' ' LYS . 10.0 mp -83.6 -44.28 14.76 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 114.998 -1.001 . . . . 0.93 110.33 173.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.505 ' SD ' ' HE3' ' A' ' 96' ' ' LYS . 46.4 ttp -68.14 128.7 93.22 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.111 -0.949 . . . . 1.15 111.443 -173.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -64.89 149.61 89.3 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.142 2.561 . . . . 0.9 112.808 -175.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 71.9 Cg_exo -51.89 -27.95 29.58 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.096 3.197 . . . . 0.96 113.04 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -64.48 -57.42 9.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.26 0.553 . . . . 1.83 109.584 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 -28.33 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.797 -0.638 . . . . 0.82 110.577 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -68.89 -40.72 79.03 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.8 -0.636 . . . . 2.16 110.758 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.67 -53.1 60.7 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.378 0.511 . . . . 1.06 112.378 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 69.1 t80 -57.21 -41.78 80.1 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.458 0.54 . . . . 0.65 112.458 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 25' ' ' LEU . 91.6 mt -88.85 -13.79 38.41 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 118.955 0.798 . . . . 1.13 111.402 177.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.45 -42.39 92.4 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.241 -0.652 . . . . 2.06 109.241 164.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -68.1 -53.24 26.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.331 -0.849 . . . . 1.84 111.26 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.448 HD22 ' CB ' ' A' ' 29' ' ' ASP . 14.0 mt -56.17 129.91 42.08 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.545 0.688 . . . . 1.05 111.12 -177.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 m -143.47 -83.43 0.16 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.797 -1.092 . . . . 1.78 110.926 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.4 142.87 44.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.522 -0.308 . . . . 2.39 110.651 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.81 -45.1 3.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.946 -0.645 . . . . 0.93 112.959 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.561 ' O ' HG12 ' A' ' 32' ' ' VAL . 5.2 m-20 -57.02 -47.32 81.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 2.25 110.696 -177.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 mmtm -57.08 -31.21 65.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.833 -0.621 . . . . 1.31 111.35 -174.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -67.8 -32.05 72.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.585 . . . . 0.8 111.473 -178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 29' ' ' ASP . 4.7 p -95.18 -28.05 4.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.048 -0.523 . . . . 0.85 111.722 -172.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.464 HD12 ' HE2' ' A' ' 37' ' ' PHE . 4.0 mm? -55.8 -45.95 78.13 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.707 0.262 . . . . 0.98 111.707 175.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -62.15 -30.44 71.05 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.66 0.266 . . . . 2.41 111.303 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -69.51 -37.06 77.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.331 -0.395 . . . . 1.96 110.611 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 86.8 t -71.97 -51.88 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.5 0.666 . . . . 0.98 110.233 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.675 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 24.0 m-85 -59.93 -41.47 91.84 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.068 1.507 . . . . 0.83 115.068 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -80.25 2.18 25.53 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.628 -0.829 . . . . 2.18 111.293 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -98.07 -80.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.708 -0.678 . . . . 1.56 109.623 172.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.44 -157.98 0.63 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.761 -0.733 . . . . 1.54 112.96 -172.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -93.88 153.29 14.77 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.042 -1.232 . . . . 1.68 111.49 -7.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 25.7 m-85 -117.41 132.22 56.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.032 -0.531 . . . . 1.28 110.864 -173.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 22.2 pttp -87.91 -12.71 43.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.481 -0.781 . . . . 3.51 109.907 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.552 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -159.84 151.79 20.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.617 -0.719 . . . . 1.52 109.532 -179.308 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.8 m -60.1 -22.02 62.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.615 . . . . 1.18 112.037 -174.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.02 -40.24 80.33 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.816 0.341 . . . . 2.24 110.801 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.3 mt-10 -64.77 -31.51 72.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 2.26 111.086 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.3 t -75.61 -37.63 59.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 1.19 109.831 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.11 -42.89 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.55 109.655 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.06 -49.28 76.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.047 -0.979 . . . . 0.57 111.361 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.85 95.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.848 -0.614 . . . . 0.5 110.669 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.28 -35.41 76.02 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 115.443 -0.799 . . . . 0.45 111.43 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -65.39 -36.61 84.48 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.028 0.442 . . . . 1.22 110.814 175.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -66.75 -50.15 63.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 3.05 110.363 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HB3' HG21 ' A' ' 32' ' ' VAL . 43.0 mmtt -66.55 -55.34 15.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 1.48 111.915 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.6 t -139.92 95.47 8.62 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 110.199 -0.297 . . . . 1.16 110.199 -175.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.16 -58.94 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.922 3.081 . . . . 0.58 113.424 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.35 -29.49 70.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.231 -0.895 . . . . 2.45 112.064 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.83 -40.6 68.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.28 -1.007 . . . . 1.42 108.28 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.99 -31.39 78.42 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.37 111.683 175.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.12 -43.08 68.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.28 -0.267 . . . . 0.48 110.28 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -58.68 -45.16 90.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.255 -0.43 . . . . 2.17 111.323 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.41 -33.3 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.284 . . . . 1.12 111.121 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.03 -52.72 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.657 -0.247 . . . . 1.7 111.152 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -59.52 -36.49 76.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.43 0.633 . . . . 3.96 110.153 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.461 HD13 ' C ' ' A' ' 66' ' ' LEU . 2.4 tm? -66.44 -45.95 78.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.896 -1.047 . . . . 1.5 110.461 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -77.0 -27.62 54.73 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.357 -0.609 . . . . 2.34 109.357 -171.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.91 96.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.223 -0.899 . . . . 0.4 111.461 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 49.6 mtm -59.37 -51.3 70.49 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.712 0.768 . . . . 0.72 109.32 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.6 t -52.41 -48.32 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 CA-C-N 114.121 -1.4 . . . . 0.79 110.474 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 9.5 mmmm -61.6 -41.15 97.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.422 -0.808 . . . . 1.47 111.814 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 t -58.7 -40.68 84.32 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.093 0.473 . . . . 1.26 110.787 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.8 mttm -74.01 -41.69 61.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.905 -0.588 . . . . 1.54 110.691 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.457 HD11 HD12 ' A' ' 89' ' ' ILE . 64.2 mt -68.2 -24.5 30.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.379 0.609 . . . . 0.34 110.662 177.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -39.66 71.56 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.667 -0.697 . . . . 0.35 109.969 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.83 -46.52 62.58 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.939 -1.028 . . . . 0.49 109.973 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 135' ' ' GLN . 7.1 tp -40.62 132.68 2.12 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 114.858 -1.064 . . . . 0.71 112.723 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 159.71 49.34 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.562 -0.745 . . . . 0.76 112.306 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -46.83 -41.12 25.32 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.795 2.997 . . . . 1.56 113.722 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.4 -53.81 46.51 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.266 0.555 . . . . 2.52 110.393 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.553 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -78.02 -29.13 49.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.731 -0.668 . . . . 0.36 111.099 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 25.8 ttpp -58.01 -42.52 85.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.722 -0.672 . . . . 2.04 110.53 176.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.35 -42.53 98.9 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.732 -0.747 . . . . 0.41 111.676 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.458 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.6 t80 -65.94 -46.06 79.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.445 0.164 . . . . 1.65 110.962 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.019 0.437 . . . . 0.41 111.363 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.93 -23.37 65.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 1.96 111.209 -176.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -85.93 -49.81 7.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.448 -0.342 . . . . 2.12 110.942 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.3 p -62.21 -40.71 97.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.327 -0.397 . . . . 0.57 111.272 -176.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.457 HD12 HD11 ' A' ' 74' ' ' ILE . 43.5 mt -62.11 -37.15 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 116.172 -0.467 . . . . 1.09 111.322 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -69.59 -36.71 76.48 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.768 -0.373 . . . . 2.82 110.717 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.11 -48.85 86.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.325 0.584 . . . . 0.51 109.801 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.8 68.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.592 -0.731 . . . . 0.64 111.1 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.2 -41.41 99.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 4.42 110.133 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -67.45 -32.45 79.17 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.059 -0.591 . . . . 0.66 112.409 -177.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mm -61.13 -43.32 96.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.0 0.429 . . . . 0.55 110.911 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.505 ' HE3' ' SD ' ' A' ' 14' ' ' MET . 3.5 mppt? -100.57 15.79 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.002 0.43 . . . . 2.7 110.529 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.675 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -93.34 -31.1 14.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.661 -0.699 . . . . 0.63 109.22 168.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.579 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 14.4 ptm180 -86.36 -1.49 57.58 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.842 -0.617 . . . . 3.1 109.941 173.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -81.16 -26.76 35.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.037 -0.727 . . . . 0.97 109.037 164.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.596 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 24.0 m-85 -75.18 -48.89 21.37 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.404 0.621 . . . . 1.48 110.353 177.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 26.7 p -67.43 -15.6 63.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 0.87 112.906 -173.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.12 32.84 10.13 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.821 -0.704 . . . . 1.16 112.401 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.66 61.71 1.4 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.705 -0.48 . . . . 1.83 109.705 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 104' ' ' GLU . 4.8 mp0 -45.5 119.67 4.53 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-N 115.205 -0.907 . . . . 1.75 111.999 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 35.8 Cg_endo -67.7 153.63 75.47 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.57 2.18 . . . . 0.53 111.629 175.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 108' ' ' ASP . 9.1 t -93.35 175.71 6.66 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.564 -0.902 . . . . 1.48 108.564 173.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 31.5 mtmt -62.71 -33.8 75.85 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.487 -0.485 . . . . 2.88 110.199 -175.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.432 ' H ' HG23 ' A' ' 106' ' ' THR . 3.4 m-20 -58.95 -38.65 79.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.455 -0.793 . . . . 2.24 111.197 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . 0.402 ' OD2' HG22 ' A' ' 106' ' ' THR . 37.1 m-20 -61.23 -44.16 97.71 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.023 -0.362 . . . . 1.73 110.023 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -67.59 -42.66 82.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.753 -0.658 . . . . 0.82 110.749 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.9 mtpm? -55.61 -48.19 75.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.258 0.551 . . . . 1.74 110.325 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.48 93.06 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.31 -0.859 . . . . 0.47 111.412 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 79.5 p -64.79 -38.38 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.172 0.434 . . . . 1.34 112.172 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 152' ' ' ALA . 13.7 m -77.6 -23.65 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.847 0.832 . . . . 0.65 109.362 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -63.96 -41.14 97.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.778 -1.101 . . . . 1.72 110.987 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.44 ' O ' HD13 ' A' ' 120' ' ' LEU . 18.1 mm-40 -72.32 -33.71 67.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.583 -0.447 . . . . 2.27 110.608 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.2 m -68.44 -34.41 65.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.546 -0.462 . . . . 0.81 110.676 177.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 114' ' ' VAL . 3.1 mm? -70.7 -33.24 70.68 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.926 -0.484 . . . . 1.21 109.963 173.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.4 ttpt -60.71 -46.02 91.97 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.146 -0.687 . . . . 0.95 109.146 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.93 -47.82 60.89 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.963 -1.017 . . . . 1.06 111.804 175.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.458 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 70.3 t80 -70.18 -35.82 74.23 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.872 -0.731 . . . . 1.54 111.745 -167.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HE3' HD12 ' A' ' 118' ' ' LEU . 75.4 mttt -67.59 -27.32 66.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.884 0.373 . . . . 1.98 111.088 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.96 -7.58 58.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.944 -0.571 . . . . 0.7 112.43 -176.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 41.2 mtm -75.68 159.25 31.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.433 -0.507 . . . . 0.5 111.047 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 m -63.43 143.33 57.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.359 -0.382 . . . . 1.18 110.66 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -56.32 -46.23 79.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.607 0.241 . . . . 2.21 111.425 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.51 74.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.004 0.431 . . . . 0.42 110.949 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.77 -35.77 58.43 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.683 -0.69 . . . . 0.31 111.761 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -66.71 -42.18 86.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.345 0.593 . . . . 1.32 110.071 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.55 -29.88 68.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 0.42 110.687 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -76.19 -32.33 58.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.227 0.537 . . . . 0.55 109.785 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.6 -30.91 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.39 109.698 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' A' ' 137' ' ' PRO . . . -75.7 0.69 60.59 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.759 -0.655 . . . . 0.27 112.724 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -99.07 -28.99 13.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.581 0.705 . . . . 2.43 109.584 175.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 50.4 mm-40 -97.95 -42.28 7.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.136 -0.938 . . . . 1.83 110.147 -176.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -135.22 70.59 68.65 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.162 -0.472 . . . . 0.69 110.11 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 133' ' ' GLY . 36.8 Cg_endo -65.88 -19.84 58.39 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.864 2.376 . . . . 0.63 112.632 -176.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 23.1 t80 -65.86 -37.82 87.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.378 -0.374 . . . . 2.31 110.564 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.604 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -78.46 -44.71 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.905 -0.405 . . . . 1.02 109.905 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.15 -32.66 66.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.456 0.646 . . . . 0.35 109.961 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.5 tttt -54.5 -74.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.563 -1.199 . . . . 2.58 111.155 170.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.97 -28.21 43.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 112.944 0.72 . . . . 0.5 112.944 -173.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.604 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 19.7 m-30 -66.32 -55.28 16.73 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.517 -0.473 . . . . 0.62 110.139 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.9 -27.89 60.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.325 -0.852 . . . . 2.58 111.383 -175.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 35.6 t -63.89 -26.95 68.83 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.531 -0.544 . . . . 1.32 109.531 174.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 104.47 -5.02 44.02 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.818 -0.706 . . . . 1.09 112.557 177.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.42 ' HG2' HD11 ' A' ' 13' ' ' LEU . 51.7 tttp -62.74 -56.33 18.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.789 0.328 . . . . 1.98 111.084 -176.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 13' ' ' LEU . . . -62.79 -36.49 83.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.34 110.632 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -57.0 -51.26 69.97 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.51 110.668 175.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 73.0 mmtt -59.95 -42.71 94.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.369 -0.378 . . . . 2.82 111.007 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -59.95 -35.16 74.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.437 0.637 . . . . 0.49 110.043 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.34 -7.99 56.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.565 -0.743 . . . . 0.59 111.891 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.191 0 C-N-CA 120.895 -0.669 . . . . 1.62 111.771 -176.264 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.821 ' CE1' ' HD3' ' A' ' 30' ' ' LYS . 2.2 p90 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-O 121.293 0.568 . . . . 1.47 109.628 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.431 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 3.3 mmmp? -117.62 -173.43 2.42 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 3.15 109.818 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.508 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 77.5 t80 -69.62 -38.95 77.42 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.584 -0.895 . . . . 2.35 108.584 173.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 1.7 mp0 -63.59 -26.21 68.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.487 -1.233 . . . . 4.16 111.628 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -78.43 -17.83 55.82 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.898 0.38 . . . . 2.57 110.969 -176.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.78 126.12 78.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 108.412 -0.959 . . . . 0.69 108.412 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -42.12 114.05 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.328 2.685 . . . . 0.6 113.041 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.43 -25.73 62.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.479 -0.782 . . . . 0.57 111.792 -176.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -62.27 -38.73 90.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 122.043 0.925 . . . . 1.37 109.677 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -80.94 -33.8 33.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.117 -1.401 . . . . 0.8 111.238 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -66.48 -22.62 66.19 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.509 0.671 . . . . 1.73 109.235 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -72.85 -10.34 59.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.485 -1.234 . . . . 1.02 111.631 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -100.64 -42.33 6.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.689 0.281 . . . . 0.93 111.55 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.466 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 25.9 ptt? -76.03 144.2 75.26 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.988 0.423 . . . . 1.15 110.962 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.35 156.05 55.12 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.133 2.555 . . . . 0.9 113.623 -172.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -42.41 -47.57 7.28 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.735 2.957 . . . . 0.96 114.262 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.559 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.6 pm0 -56.56 -45.41 81.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.788 0.267 . . . . 1.83 111.687 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.37 -16.04 62.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.191 0.52 . . . . 0.82 110.992 -178.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.466 ' HD2' ' O ' ' A' ' 14' ' ' MET . 32.0 mtp180 -90.98 -32.31 16.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.795 -0.639 . . . . 2.16 110.076 177.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 18.0 t70 -56.26 -49.32 74.54 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.67 -0.696 . . . . 1.06 111.86 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.575 ' O ' HD23 ' A' ' 25' ' ' LEU . 60.1 t80 -54.45 -57.54 10.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.43 -0.35 . . . . 0.65 111.349 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.612 HD21 ' OH ' ' A' ' 100' ' ' TYR . 88.6 mt -78.08 -6.69 55.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 119.06 0.846 . . . . 1.13 112.062 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 29.9 tt0 -68.66 -34.67 76.09 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.009 0.433 . . . . 2.06 110.077 163.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -77.93 -54.48 6.26 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.176 -0.466 . . . . 1.84 110.954 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.575 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.3 mm? -55.27 132.02 46.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 1.05 110.488 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 38.5 m -137.37 -88.0 0.28 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 120.507 -0.477 . . . . 1.78 112.206 -172.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -132.58 119.41 20.45 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.898 0.38 . . . . 2.39 111.096 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.62 -46.94 1.07 Allowed Glycine 0 CA--C 1.542 1.765 0 N-CA-C 115.459 0.944 . . . . 0.93 115.459 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.571 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.3 OUTLIER -95.2 -6.84 40.72 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.206 1.558 . . . . 2.25 115.206 -170.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.821 ' HD3' ' CE1' ' A' ' 1' ' ' PHE . 90.7 mttt -80.59 -15.89 55.49 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.024 -1.102 . . . . 1.31 108.024 171.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -61.2 -31.59 71.36 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.567 -1.197 . . . . 0.8 110.235 175.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.571 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.5 p -89.95 -23.98 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 115.983 -0.553 . . . . 0.85 110.594 -178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.54 HD13 HD21 ' A' ' 52' ' ' LEU . 3.7 mm? -54.3 -52.41 61.57 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.194 0.198 . . . . 0.98 111.065 170.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -62.11 -29.59 70.44 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.681 0.277 . . . . 2.41 111.235 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.69 -41.89 99.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.04 -0.527 . . . . 1.96 110.348 175.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.622 HG12 ' OH ' ' A' ' 42' ' ' TYR . 63.7 t -68.42 -49.68 63.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.295 0.569 . . . . 0.98 110.147 177.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.67 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.0 m-85 -55.4 -49.32 72.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 114.138 1.162 . . . . 0.83 114.138 177.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -77.38 -5.46 49.77 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.937 -0.705 . . . . 2.18 111.262 -174.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -90.02 -76.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.942 -0.572 . . . . 1.56 109.559 169.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.63 -155.34 1.55 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.299 -0.476 . . . . 1.54 112.881 -175.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -98.49 154.65 7.43 Favored 'Cis proline' 0 N--CA 1.454 -0.826 0 CA-C-N 118.472 1.136 . . . . 1.68 111.938 -7.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.622 ' OH ' HG12 ' A' ' 36' ' ' VAL . 1.0 OUTLIER -104.8 124.78 50.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.176 0.513 . . . . 1.28 110.71 -175.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -89.79 -13.62 36.28 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.684 -0.858 . . . . 3.51 108.684 171.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.1 p30 -148.69 149.87 32.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.831 -1.077 . . . . 1.52 108.51 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 t -70.31 -16.28 62.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.004 0.431 . . . . 1.18 110.887 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.606 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 32.3 tt0 -60.13 -36.73 78.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.933 -0.576 . . . . 2.24 110.267 175.117 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -60.88 -38.85 87.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.212 -0.449 . . . . 2.26 111.051 177.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.5 t -64.97 -41.7 95.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.229 -0.442 . . . . 1.19 110.11 178.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.499 HD11 ' ND1' ' A' ' 67' ' ' HIS . 78.0 mt -66.28 -48.4 81.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.192 -0.458 . . . . 0.55 110.641 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.53 76.44 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.577 -0.738 . . . . 0.57 111.899 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.83 -38.64 82.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.171 0.51 . . . . 0.5 110.738 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.54 HD21 HD13 ' A' ' 33' ' ' LEU . 20.2 mt -72.6 -33.46 66.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.669 -0.696 . . . . 0.45 111.462 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -66.29 -26.38 67.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.031 0.443 . . . . 1.22 110.833 175.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -77.44 -50.21 13.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.759 -0.655 . . . . 3.05 110.532 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 32' ' ' VAL . 33.7 mmtt -65.38 -59.87 3.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.601 -0.727 . . . . 1.48 111.981 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.6 t -138.51 99.41 8.66 Favored Pre-proline 0 C--N 1.316 -0.869 0 C-N-CA 120.472 -0.491 . . . . 1.16 110.811 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -40.3 -57.95 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.944 3.096 . . . . 0.58 113.176 -172.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -56.59 -35.61 68.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.49 -1.232 . . . . 2.45 111.933 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.419 HD11 ' HB3' ' A' ' 29' ' ' ASP . 53.9 mt -76.11 -41.32 50.61 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 119.575 -0.85 . . . . 1.42 109.23 -174.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.446 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -61.58 -35.14 90.68 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.42 -1.263 . . . . 0.37 111.801 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.6 68.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.92 0.39 . . . . 0.48 110.425 174.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 2.7 tppt? -67.22 -47.4 70.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.948 -0.569 . . . . 2.17 110.768 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.478 HG23 HH21 ' A' ' 93' ' ' ARG . 13.4 p -69.65 -26.7 31.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.182 0.515 . . . . 1.12 110.376 176.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -64.56 -52.98 54.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.63 -0.714 . . . . 1.7 110.954 176.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 66' ' ' LEU . 45.3 pttt -65.7 -30.59 71.3 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.727 -0.842 . . . . 3.96 108.727 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.95 -0.03 12.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 114.391 -1.277 . . . . 1.5 110.389 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.499 ' ND1' HD11 ' A' ' 49' ' ' ILE . 13.5 m80 -113.64 -48.25 2.94 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 115.843 -0.617 . . . . 2.34 110.201 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.55 76.85 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.173 0.434 . . . . 0.4 112.173 -178.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 44.0 mtm -66.63 -47.7 71.76 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.239 0.542 . . . . 0.72 110.433 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.466 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 93.8 t -62.31 -41.85 93.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.424 -0.807 . . . . 0.79 110.161 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 8.0 mmmm -63.26 -30.78 71.85 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 115.157 -0.929 . . . . 1.47 111.417 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 40.7 t -62.37 -43.31 99.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.289 0.566 . . . . 1.26 110.553 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -69.54 -39.02 77.7 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.343 -0.614 . . . . 1.54 109.343 177.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.536 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 75.1 mt -77.16 -14.37 14.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.652 0.739 . . . . 0.34 111.148 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.74 -34.32 27.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.831 0.824 . . . . 0.35 109.325 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.65 -0.68 57.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.972 -1.467 . . . . 0.49 110.084 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.417 HD12 ' OD2' ' A' ' 131' ' ' ASP . 13.6 tp -91.4 138.39 31.62 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.462 -0.79 . . . . 0.71 109.827 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.08 151.23 27.18 Favored Glycine 0 C--O 1.227 -0.3 0 CA-C-N 115.928 -0.578 . . . . 0.76 112.537 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -43.52 -42.72 11.05 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.921 3.081 . . . . 1.56 114.179 -176.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 0.3 OUTLIER -81.02 -41.89 21.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.592 -0.276 . . . . 2.52 111.417 -177.085 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.22 82.3 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.568 0.699 . . . . 0.36 109.935 178.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.536 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 28.6 ttpp -53.54 -48.22 69.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.596 -1.184 . . . . 2.04 111.389 174.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.7 -39.69 91.6 Favored Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.798 -0.715 . . . . 0.41 112.191 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -67.34 -46.63 72.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.643 0.258 . . . . 1.65 110.869 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.01 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.088 0.471 . . . . 0.41 111.413 -177.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 41.2 mt-10 -65.71 -23.94 66.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.768 -0.651 . . . . 1.96 111.492 -176.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -93.98 -42.72 8.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 116.736 -0.211 . . . . 2.12 111.359 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.3 p -60.38 -45.08 94.8 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.737 0.304 . . . . 0.57 111.037 -177.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.592 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 1.7 mp -56.49 -40.13 66.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 1.09 110.481 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -74.74 -35.08 62.63 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.121 0.415 . . . . 2.82 112.121 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.537 HG22 ' OG ' ' A' ' 113' ' ' SER . 65.4 mt -63.84 -48.26 87.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.034 0.445 . . . . 0.51 109.834 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.7 -30.03 70.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.699 -0.682 . . . . 0.64 110.712 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.592 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 11.5 ttt85 -70.49 -40.58 73.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.302 -0.863 . . . . 4.42 110.67 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.71 -32.29 83.67 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 121.255 -0.498 . . . . 0.66 112.328 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.7 mm -62.63 -44.53 99.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.275 0.559 . . . . 0.55 110.715 177.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 36.7 mtmm -91.74 8.85 35.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.903 -0.59 . . . . 2.7 110.275 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.67 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -97.02 -33.15 11.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.781 -0.645 . . . . 0.63 109.61 171.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.418 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 13.8 ptp180 -83.51 -3.34 57.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.161 -0.681 . . . . 3.1 109.161 172.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.492 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.112 -0.699 . . . . 0.97 109.112 164.345 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' HD21 ' A' ' 22' ' ' LEU . 26.9 m-85 -70.17 -48.53 56.87 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.033 -0.53 . . . . 1.48 110.97 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.5 p -62.15 -19.97 63.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.289 -0.869 . . . . 0.87 112.722 -173.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.39 1.72 40.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.695 -0.764 . . . . 1.16 112.208 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -101.41 60.32 0.9 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.648 -0.501 . . . . 1.83 109.648 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 48.4 mt-10 -50.77 116.11 6.64 Favored Pre-proline 0 C--O 1.234 0.251 0 O-C-N 123.817 0.698 . . . . 1.75 111.691 -173.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 31.6 Cg_endo -64.57 157.16 56.81 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 123.49 2.793 . . . . 0.53 113.324 -174.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.416 ' O ' HD13 ' A' ' 110' ' ' LEU . 75.3 p -87.86 178.0 6.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.524 -0.307 . . . . 1.48 110.31 174.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.64 -25.49 65.76 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.126 0.489 . . . . 2.88 109.972 175.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.469 ' HA ' ' HG2' ' A' ' 111' ' ' LYS . 23.3 m-20 -71.11 -30.84 67.03 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.917 -0.583 . . . . 2.24 110.541 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.15 -46.48 80.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.19 0.519 . . . . 1.73 109.802 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' THR . 10.2 mp -64.91 -47.89 76.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.601 -0.727 . . . . 0.82 111.691 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 108' ' ' ASP . 16.0 ptpt -60.89 -38.5 85.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.912 0.387 . . . . 1.74 110.283 -177.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.21 75.27 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.926 -0.579 . . . . 0.47 111.229 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.537 ' OG ' HG22 ' A' ' 91' ' ' ILE . 24.7 t -55.33 -48.01 74.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.986 -0.552 . . . . 1.34 110.925 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.619 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.6 m -77.29 -28.04 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.547 0.689 . . . . 0.65 109.534 -176.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 22.2 ttmm -59.11 -44.82 92.01 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.208 -0.905 . . . . 1.72 111.675 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.485 ' O ' HD13 ' A' ' 120' ' ' LEU . 20.3 mt-10 -71.14 -34.32 70.9 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.026 -0.67 . . . . 2.27 111.253 -176.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.1 m -68.89 -22.41 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 C-N-CA 120.365 -0.534 . . . . 0.81 109.728 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 149' ' ' ALA . 22.0 mt -83.44 -36.82 23.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.483 -0.326 . . . . 1.21 110.485 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.62 -39.53 80.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.615 0.722 . . . . 0.95 109.293 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -73.11 -48.74 33.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.896 -1.047 . . . . 1.06 112.165 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.626 ' CE2' ' HB3' ' A' ' 143' ' ' PHE . 0.0 OUTLIER -70.59 -35.52 73.07 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 119.011 -1.075 . . . . 1.54 111.234 -168.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -61.72 -33.12 73.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.006 0.431 . . . . 1.98 110.59 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.09 -1.7 57.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.7 112.464 -176.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.577 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 50.8 mtm -74.82 157.81 34.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.333 -0.547 . . . . 0.5 111.076 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.5 m -63.21 149.08 46.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.148 -0.478 . . . . 1.18 110.368 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -59.34 -43.28 92.78 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.543 0.211 . . . . 2.21 111.534 -174.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.41 -25.96 68.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.836 0.35 . . . . 0.42 111.046 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.76 -36.79 31.85 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.801 -0.714 . . . . 0.31 111.608 177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.577 ' HE3' ' O ' ' A' ' 124' ' ' MET . 97.5 mttt -65.46 -45.57 83.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.449 0.643 . . . . 1.32 110.014 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.31 -41.27 94.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.091 -0.958 . . . . 0.42 111.652 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.417 ' OD2' HD12 ' A' ' 77' ' ' LEU . 38.7 t70 -71.55 -31.47 67.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.059 0.457 . . . . 0.55 109.853 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -61.86 -29.09 69.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.865 -0.607 . . . . 0.39 110.148 173.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . 0.411 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -72.73 -22.15 79.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.98 -0.629 . . . . 0.27 112.737 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -81.87 -35.39 29.35 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.716 0.769 . . . . 2.43 109.867 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 6.5 mm100 -89.86 -36.88 14.82 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.521 -1.218 . . . . 1.83 110.794 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.466 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 48.7 m-85 -130.21 79.27 73.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.022 0.439 . . . . 0.69 110.408 175.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.98 -37.75 32.05 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 123.146 2.564 . . . . 0.63 113.141 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 41.6 t80 -69.3 -38.05 78.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.814 0.34 . . . . 2.31 110.592 -175.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.3 mt -75.58 -44.02 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.02 110.956 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.411 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.76 -37.51 76.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.988 0.423 . . . . 0.35 109.961 177.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 16.9 tppt? -48.1 -69.51 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.212 -0.903 . . . . 2.58 111.532 171.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.8 m -63.57 -27.45 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 115.372 -0.831 . . . . 0.5 112.569 -174.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 22.7 m-30 -74.79 -54.12 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.065 -0.654 . . . . 0.62 110.263 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.79 -32.45 73.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 2.58 111.941 -176.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.2 t -75.24 -7.9 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.511 -0.313 . . . . 1.32 110.859 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.7 13.17 83.81 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.867 -0.683 . . . . 1.09 111.774 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.37 -56.09 9.73 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.972 0.415 . . . . 1.98 110.525 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.82 70.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.952 -0.567 . . . . 0.34 110.073 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -61.25 -36.82 81.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.46 -0.791 . . . . 0.51 111.137 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.06 -32.76 61.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 2.82 110.169 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -68.51 -31.33 70.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.92 -0.582 . . . . 0.49 109.901 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.496 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.6 -15.85 62.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.961 -0.563 . . . . 0.59 110.851 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.779 0 CA-C-N 115.839 -0.619 . . . . 1.62 113.101 176.399 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.524 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 13.6 p90 . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 109.029 -0.73 . . . . 1.47 109.029 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.488 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 4.2 mmmp? -129.32 171.72 12.21 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.667 0.27 . . . . 3.15 110.906 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.615 ' OH ' ' HD2' ' A' ' 19' ' ' ARG . 87.1 t80 -56.97 -41.32 78.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.508 0.67 . . . . 2.35 109.89 175.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.488 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 2.1 mp0 -64.35 -24.5 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.809 -1.087 . . . . 4.16 111.999 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -82.91 -14.67 53.75 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.561 -0.456 . . . . 2.57 110.649 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.6 mt -82.18 128.9 66.03 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.222 -0.658 . . . . 0.69 109.222 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -42.49 115.18 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.573 2.849 . . . . 0.6 112.763 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -21.67 66.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.57 112.112 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.35 -37.07 82.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.792 0.806 . . . . 1.37 109.685 178.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -80.91 -28.76 35.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.396 -1.274 . . . . 0.8 111.127 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 14.8 mtm180 -69.46 -21.28 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.723 -0.473 . . . . 1.73 109.723 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.467 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 13.3 t70 -65.68 -21.14 66.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.313 -0.858 . . . . 1.02 110.52 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.2 mt -89.41 -12.43 40.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.947 -0.57 . . . . 0.93 110.937 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 68.1 mtm -95.35 129.2 35.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.029 0.442 . . . . 1.15 110.531 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.474 ' HB2' ' OE1' ' A' ' 17' ' ' GLU . 38.3 Cg_endo -66.67 153.02 79.46 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.858 2.372 . . . . 0.9 112.53 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -42.97 -47.14 8.51 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.384 2.723 . . . . 0.96 113.882 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 15' ' ' PRO . 1.6 pm0 -60.81 -45.3 94.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.661 0.267 . . . . 1.83 111.609 -178.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -28.46 69.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.82 110.856 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.615 ' HD2' ' OH ' ' A' ' 3' ' ' TYR . 45.3 mtm105 -89.11 -29.03 19.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.924 -0.58 . . . . 2.16 111.132 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 28.4 t70 -56.02 -38.84 71.07 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.419 0.628 . . . . 1.06 111.134 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.606 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.2 t80 -57.71 -58.78 6.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.55 -0.75 . . . . 0.65 110.985 174.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.468 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.0 mt -75.04 -7.82 54.78 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 119.456 1.026 . . . . 1.13 111.941 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.462 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 6.3 tp60 -67.57 -41.63 83.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.247 0.546 . . . . 2.06 110.187 162.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -73.8 -52.46 13.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.585 -0.734 . . . . 1.84 110.838 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -50.61 121.36 5.69 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.632 1.206 . . . . 1.05 112.737 -177.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.711 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 15.6 m -141.17 -169.43 2.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 112.547 -2.115 . . . . 1.78 107.938 178.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -57.13 144.05 36.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 118.28 0.491 . . . . 2.39 111.026 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.9 -58.18 0.63 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.799 -0.715 . . . . 0.93 112.248 -178.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.653 ' O ' HG12 ' A' ' 32' ' ' VAL . 40.9 m-20 -87.12 -30.95 20.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.571 0.224 . . . . 2.25 111.29 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.711 ' HG3' ' O ' ' A' ' 26' ' ' SER . 3.0 mtpm? -69.75 -17.97 63.48 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.659 -0.651 . . . . 1.31 110.072 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.434 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 9.9 m -64.75 -36.24 83.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.894 -1.048 . . . . 0.8 110.823 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.661 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 12.2 p -81.99 -32.02 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 116.183 -0.462 . . . . 0.85 112.147 -174.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.587 HD13 HD21 ' A' ' 52' ' ' LEU . 4.4 mm? -55.08 -42.74 73.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.348 . . . . 0.98 110.062 175.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 34' ' ' LYS . 3.7 ttpm? -63.29 -29.01 70.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.427 0.632 . . . . 2.41 110.341 -178.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 31' ' ' THR . 9.8 mm-40 -79.26 -45.33 19.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.232 -0.895 . . . . 1.96 110.769 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 32' ' ' VAL . 12.0 m -75.79 -37.0 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 112.276 0.473 . . . . 0.98 112.276 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -62.12 -43.97 97.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.812 1.042 . . . . 0.83 113.812 171.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -80.51 -17.48 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.694 -0.803 . . . . 2.18 110.57 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.58 -77.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 1.56 109.904 168.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.78 -147.16 2.37 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 121.058 -0.591 . . . . 1.54 112.558 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -91.22 123.14 4.82 Favored 'Cis proline' 0 N--CA 1.457 -0.654 0 CA-C-N 118.747 1.274 . . . . 1.68 110.541 -12.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 21.4 m-85 -99.04 116.95 32.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.55 0.69 . . . . 1.28 111.873 -169.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -71.02 -15.88 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.708 -1.133 . . . . 3.51 111.422 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 46' ' ' GLU . 9.1 p30 -147.2 164.45 33.12 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.156 -0.313 . . . . 1.52 110.156 -174.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.458 HG21 ' CD2' ' A' ' 67' ' ' HIS . 9.2 m -73.18 -32.22 64.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 1.18 111.918 -176.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.435 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 50.1 mt-10 -58.36 -41.81 85.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.565 0.222 . . . . 2.24 111.051 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.3 OUTLIER -61.98 -33.51 74.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.588 -0.278 . . . . 2.26 111.529 176.629 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.4 m -71.69 -40.29 69.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.27 0.557 . . . . 1.19 109.821 177.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.84 -44.86 98.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.34 -0.845 . . . . 0.55 110.266 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.578 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -55.9 -49.24 73.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.368 -0.833 . . . . 0.57 111.255 175.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB1' ' CG1' ' A' ' 36' ' ' VAL . . . -53.33 -41.6 65.89 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.987 -0.551 . . . . 0.5 111.017 178.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 33' ' ' LEU . 63.3 mt -70.54 -40.82 73.19 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.801 -0.636 . . . . 0.45 111.199 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -62.89 -33.64 75.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.08 0.4 . . . . 1.22 112.08 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 33.4 mmtp -71.91 -28.44 63.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.393 -0.367 . . . . 3.05 111.463 -177.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -99.02 -50.53 4.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.08 0.466 . . . . 1.48 110.818 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 t -127.42 93.67 40.2 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.697 -0.853 . . . . 1.16 108.697 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.93 -53.31 7.28 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.798 2.998 . . . . 0.58 112.63 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 17.1 tp10 -57.34 -37.68 72.94 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 114.481 -1.236 . . . . 2.45 111.655 177.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 29' ' ' ASP . 1.6 tt -70.04 -45.78 66.42 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.246 -1.02 . . . . 1.42 108.246 -174.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.417 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.88 -32.43 84.14 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 114.235 -1.348 . . . . 0.37 111.865 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.78 81.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.809 0.338 . . . . 0.48 110.528 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 96.2 mttt -62.72 -53.02 60.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.087 -0.506 . . . . 2.17 110.836 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.417 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.7 p -67.61 -28.71 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.489 -0.323 . . . . 1.12 111.203 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -62.04 -60.02 4.22 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 110.096 -0.335 . . . . 1.7 110.096 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.647 ' O ' ' HG3' ' A' ' 69' ' ' MET . 70.8 mmtt -64.14 -36.64 84.69 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.298 0.57 . . . . 3.96 109.827 -176.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 21' ' ' PHE . 15.1 tp -63.24 -38.79 92.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.94 -1.027 . . . . 1.5 110.648 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.458 ' CD2' HG21 ' A' ' 45' ' ' THR . 48.6 t-80 -81.62 -33.34 31.53 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.746 -0.661 . . . . 2.34 109.62 -175.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.69 -36.56 83.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.222 -0.899 . . . . 0.4 111.185 177.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.647 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 26.6 mtm -63.38 -54.15 41.31 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.203 0.525 . . . . 0.72 109.918 176.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.2 t -54.74 -40.77 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.296 -0.866 . . . . 0.79 110.108 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.66 -40.73 92.76 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.77 -1.105 . . . . 1.47 111.207 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.3 m -57.57 -37.69 73.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 1.26 110.721 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.8 mttm -67.45 -46.69 72.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 1.54 110.31 176.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.88 -29.29 42.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.005 0.431 . . . . 0.34 111.698 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.33 -37.47 85.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.487 0.66 . . . . 0.35 109.956 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.61 -1.47 56.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.789 -1.096 . . . . 0.49 111.152 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 132' ' ' PHE . 8.9 tp -92.85 134.99 34.54 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.169 -0.469 . . . . 0.71 109.857 -176.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.63 149.83 51.58 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.599 -0.81 . . . . 0.76 111.846 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -39.05 -36.33 0.7 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 124.381 3.387 . . . . 1.56 114.452 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.88 -56.03 18.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.335 0.588 . . . . 2.52 109.68 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.94 -29.99 35.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.664 -0.698 . . . . 0.36 110.807 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -61.74 -38.85 89.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.578 -0.737 . . . . 2.04 110.86 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.57 -40.24 95.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.584 -0.817 . . . . 0.41 111.443 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 32.7 t80 -67.79 -49.88 59.96 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.837 -0.181 . . . . 1.65 111.223 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.97 -51.89 59.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.945 0.403 . . . . 0.41 112.004 -176.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -71.06 -27.7 63.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.335 -0.393 . . . . 1.96 111.359 -175.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.495 ' O ' ' HB3' ' A' ' 90' ' ' GLU . 58.7 tttp -84.08 -39.48 19.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.552 0.215 . . . . 2.12 111.049 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 p -65.24 -46.09 82.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.795 0.331 . . . . 0.57 110.228 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.84 -31.59 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.017 -0.538 . . . . 1.09 110.339 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.495 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 9.3 tp10 -61.91 -47.56 84.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.884 0.374 . . . . 2.82 110.269 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.465 HG22 ' OG ' ' A' ' 113' ' ' SER . 71.9 mt -63.09 -46.86 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.51 110.398 178.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.413 ' O ' ' HD2' ' A' ' 96' ' ' LYS . . . -64.33 -35.97 82.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.827 -0.624 . . . . 0.64 110.829 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.451 ' HA ' ' HD3' ' A' ' 96' ' ' LYS . 46.1 mtm180 -62.18 -41.46 98.35 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.795 -0.639 . . . . 4.42 110.813 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.525 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -60.82 -33.94 85.08 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.768 -0.729 . . . . 0.66 112.013 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.5 mm -64.0 -43.42 97.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.598 0.237 . . . . 0.55 111.508 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.506 ' HZ2' ' HB3' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -93.48 -9.47 38.31 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 119.916 -0.714 . . . . 2.7 110.753 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.21 78.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.056 0.455 . . . . 0.63 109.891 170.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 12.1 ptm180 -85.23 3.43 39.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 3.1 110.043 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.2 m-85 -90.42 -45.51 8.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.037 -0.727 . . . . 0.97 109.037 162.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.524 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 35.2 m-85 -59.63 -34.25 72.55 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 1.48 111.785 -177.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.5 p -71.73 -2.66 18.26 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.404 0.52 . . . . 0.87 112.404 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 92.58 31.64 8.68 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.807 -0.711 . . . . 1.16 112.304 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 44.7 m-80 -130.8 176.23 8.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.53 -0.545 . . . . 1.83 109.53 -178.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 49.8 mt-10 -142.73 106.87 5.43 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 111.654 0.242 . . . . 1.75 111.654 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.4 Cg_endo -59.17 160.29 19.58 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.834 2.356 . . . . 0.53 111.886 173.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 72.2 p -86.1 165.15 16.83 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.127 -0.694 . . . . 1.48 109.127 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 8.7 ptpp? -61.97 -23.72 66.56 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.334 -0.546 . . . . 2.88 109.88 177.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.412 ' HA ' ' HD2' ' A' ' 111' ' ' LYS . 16.4 m-20 -72.27 -32.43 66.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.693 -0.685 . . . . 2.24 110.937 178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -62.98 -41.29 99.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.421 0.629 . . . . 1.73 109.694 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.425 ' O ' HG13 ' A' ' 114' ' ' VAL . 7.5 mp -66.19 -41.07 90.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.229 -0.896 . . . . 0.82 110.413 177.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 93.5 mttt -54.49 -52.72 61.04 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.959 0.409 . . . . 1.74 109.939 174.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -59.84 -43.34 94.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.611 -0.722 . . . . 0.47 111.143 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.506 ' O ' HG13 ' A' ' 117' ' ' VAL . 44.2 t -55.93 -48.84 74.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 1.34 111.667 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.774 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.0 m -80.95 -24.85 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.616 0.722 . . . . 0.65 110.056 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 37.7 ttmt -66.63 -41.5 88.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 1.72 111.333 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.458 ' O ' HD13 ' A' ' 120' ' ' LEU . 12.7 mm-40 -71.87 -35.46 69.81 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.57 -0.452 . . . . 2.27 110.706 -178.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.37 -33.16 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.678 -0.409 . . . . 0.81 110.251 176.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.559 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 85.1 mt -72.78 -34.85 67.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.038 -0.356 . . . . 1.21 110.038 176.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.01 -43.8 95.0 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.148 -0.686 . . . . 0.95 109.148 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -69.83 -48.07 60.36 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.123 -0.944 . . . . 1.06 111.498 174.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.623 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 37.9 t80 -69.61 -37.92 77.07 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.878 -0.729 . . . . 1.54 111.702 -168.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -61.07 -33.02 72.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.828 0.347 . . . . 1.98 111.097 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -87.36 -8.03 57.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.746 0.647 . . . . 0.7 112.746 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -74.3 159.71 32.06 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.275 -0.57 . . . . 0.5 111.558 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -59.26 145.06 44.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.067 -0.515 . . . . 1.18 110.494 173.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.91 -43.39 98.92 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.275 -0.42 . . . . 2.21 111.999 -174.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.4 -29.74 70.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.42 110.656 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.99 -36.27 57.29 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.563 -0.744 . . . . 0.31 111.602 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.623 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 98.9 mttt -63.6 -45.98 87.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.336 0.588 . . . . 1.32 110.061 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.32 74.56 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.443 -0.799 . . . . 0.42 111.431 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -74.21 -31.95 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.601 -0.518 . . . . 0.55 109.601 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.42 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.9 t80 -60.11 -34.22 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.699 -0.682 . . . . 0.39 109.811 172.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.15 -10.42 78.2 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.27 113.202 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -87.72 -29.34 21.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.351 0.596 . . . . 2.43 110.268 177.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.5 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -100.98 -37.81 8.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.192 -0.913 . . . . 1.83 111.046 -176.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -128.05 71.47 78.94 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.907 0.384 . . . . 0.69 110.073 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -62.44 -36.66 64.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.045 2.496 . . . . 0.63 112.427 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.528 ' O ' HG13 ' A' ' 142' ' ' VAL . 61.7 t80 -64.31 -41.62 96.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.46 -0.336 . . . . 2.31 110.344 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.445 HD21 ' HD3' ' A' ' 15' ' ' PRO . 94.9 mt -72.02 -44.68 63.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.486 -0.325 . . . . 1.02 110.333 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -57.19 -40.71 77.92 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.95 -0.389 . . . . 0.35 109.95 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 22.6 ttpp -46.25 -71.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.323 -0.853 . . . . 2.58 111.193 172.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.1 m -62.83 -26.51 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.658 -0.701 . . . . 0.5 112.259 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -74.51 -41.64 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.848 -0.741 . . . . 0.62 110.488 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 37.3 mt-10 -79.68 -31.71 41.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.747 0.308 . . . . 2.58 111.073 -178.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 57.3 m -70.18 -10.76 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 1.32 111.224 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 79.41 14.99 80.78 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.853 -0.689 . . . . 1.09 111.547 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.467 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 54.8 tptt -69.49 -59.9 2.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.805 0.336 . . . . 1.98 110.585 -177.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.28 75.46 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.132 0.491 . . . . 0.34 109.781 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.559 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -59.32 -45.61 90.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.342 -0.845 . . . . 0.51 111.136 178.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -67.47 -39.81 85.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.317 -0.401 . . . . 2.82 110.405 -178.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -59.81 -39.53 85.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.917 -0.583 . . . . 0.49 110.537 176.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.774 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -73.2 -21.13 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.49 . . . . 0.59 111.515 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.784 0 N-CA-C 110.447 -1.061 . . . . 1.62 110.447 -171.746 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.2 p90 . . . . . 0 C--O 1.239 0.506 0 CA-C-O 121.103 0.478 . . . . 1.47 110.116 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 10.5 mtmp? -121.62 155.65 34.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.964 -0.562 . . . . 3.15 109.676 177.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.733 ' CE1' ' HB3' ' A' ' 22' ' ' LEU . 47.6 m-85 -83.79 -0.16 49.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.07 0.938 . . . . 2.35 109.592 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -84.16 -19.79 33.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.94 -1.482 . . . . 4.16 108.881 170.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 9.8 m-20 -96.76 -14.58 21.87 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.88 -0.6 . . . . 2.57 110.344 -174.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.08 130.69 71.74 Favored Pre-proline 0 N--CA 1.449 -0.491 0 N-CA-C 108.601 -0.889 . . . . 0.69 108.601 176.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -40.5 106.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.342 2.694 . . . . 0.6 112.533 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.79 -22.3 66.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.574 -0.739 . . . . 0.57 111.474 -174.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -63.91 -29.26 70.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.918 0.866 . . . . 1.37 109.559 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 40.4 t80 -91.8 -27.92 17.69 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.178 -1.374 . . . . 0.8 110.723 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.411 ' HD2' ' SD ' ' A' ' 14' ' ' MET . 7.3 mmm180 -68.13 -23.8 64.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.336 0.589 . . . . 1.73 109.544 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.6 -30.12 71.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.989 -1.005 . . . . 1.02 110.587 173.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.581 HD22 HG21 ' A' ' 142' ' ' VAL . 13.6 mt -82.34 -14.94 54.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.961 -0.563 . . . . 0.93 110.246 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.411 ' SD ' ' HD2' ' A' ' 11' ' ' ARG . 66.9 mtt -71.16 130.19 88.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 1.15 110.616 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 23.7 Cg_exo -63.48 126.62 18.02 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.267 1.978 . . . . 0.9 111.683 176.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -40.33 -48.78 4.06 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.963 3.109 . . . . 0.96 114.571 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -75.99 -24.17 55.32 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.814 0.301 . . . . 1.83 111.814 -175.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.34 54.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.265 -0.643 . . . . 0.82 109.265 174.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -71.61 -29.71 64.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.221 -0.899 . . . . 2.16 110.242 173.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -49.49 -53.72 21.67 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.849 0.718 . . . . 1.06 110.798 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.542 ' O ' ' HB2' ' A' ' 24' ' ' ASN . 87.6 t80 -52.88 -62.11 1.86 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.054 -0.521 . . . . 0.65 111.723 178.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.733 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 36.5 mt -69.25 -20.14 63.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 118.856 0.753 . . . . 1.13 111.821 -177.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -64.7 -31.81 73.19 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 119.187 0.903 . . . . 2.06 110.91 166.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 21' ' ' PHE . 0.9 OUTLIER -68.11 -47.65 67.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.073 -0.512 . . . . 1.84 112.178 179.505 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.495 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.2 mm? -59.53 140.54 56.19 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.32 0.581 . . . . 1.05 111.177 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 t -122.53 -68.56 0.88 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.221 -0.9 . . . . 1.78 111.463 -174.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -151.13 -70.51 0.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.016 0.376 . . . . 2.39 112.016 -174.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.36 -27.3 72.96 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.105 -0.569 . . . . 0.93 112.687 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.1 p30 -73.84 -35.66 64.82 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.892 0.377 . . . . 2.25 110.843 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.95 -30.06 71.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.006 0.432 . . . . 1.31 110.929 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 44.3 m -56.28 -43.86 79.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.656 -0.702 . . . . 0.8 111.223 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.12 -28.55 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.957 -0.565 . . . . 0.85 110.39 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -55.79 -46.72 77.9 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 121.119 0.485 . . . . 0.98 109.799 168.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.486 ' HG2' ' HE3' ' A' ' 38' ' ' LYS . 37.2 ttmt -57.06 -29.92 63.83 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.326 -0.852 . . . . 2.41 110.665 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -78.92 -34.18 44.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 1.96 111.232 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 78.4 t -71.29 -49.51 47.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.246 0.546 . . . . 0.98 110.478 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.542 ' HE2' ' CD2' ' A' ' 100' ' ' TYR . 35.4 m-85 -57.43 -24.63 56.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.174 0.805 . . . . 0.83 113.174 176.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE3' ' HG2' ' A' ' 34' ' ' LYS . 9.7 mtmp? -101.42 14.68 31.22 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.966 -0.694 . . . . 2.18 110.911 176.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.86 23.33 10.75 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.086 -0.506 . . . . 1.56 110.747 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.64 -149.86 9.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.88 -0.676 . . . . 1.54 111.852 174.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.0 162.94 86.45 Favored 'Cis proline' 0 N--CA 1.462 -0.346 0 CA-C-N 118.827 1.313 . . . . 1.68 112.064 -2.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -119.01 134.06 55.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.955 -0.566 . . . . 1.28 110.217 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -91.39 -6.29 53.13 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.099 -0.955 . . . . 3.51 109.981 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.406 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.7 p30 -156.15 149.99 25.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.619 -0.719 . . . . 1.52 109.607 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.2 m -61.6 -26.59 68.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.518 -0.765 . . . . 1.18 111.45 -177.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.99 -33.2 75.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 2.24 111.833 -177.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HG3' HD21 ' A' ' 44' ' ' ASN . 44.5 mt-10 -63.11 -35.33 79.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 2.26 110.867 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.8 t -69.68 -35.77 75.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.646 -0.501 . . . . 1.19 109.646 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 77.5 mt -66.58 -43.36 90.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.737 -0.665 . . . . 0.55 110.108 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 -50.79 72.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.305 -0.861 . . . . 0.57 111.148 176.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.77 82.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.5 110.773 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 33' ' ' LEU . 10.8 mt -68.59 -37.56 79.92 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.646 -0.706 . . . . 0.45 111.376 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -61.56 -38.96 89.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.003 0.43 . . . . 1.22 110.825 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -69.54 -50.75 41.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 3.05 110.811 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.586 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 12.5 mmtt -66.91 -43.81 82.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.8 -0.636 . . . . 1.48 112.32 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.2 m -149.86 97.17 3.47 Favored Pre-proline 0 C--N 1.315 -0.893 0 O-C-N 122.073 -0.392 . . . . 1.16 110.485 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -40.82 -56.13 1.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.86 3.04 . . . . 0.58 113.276 -171.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.57 -34.54 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.596 -1.184 . . . . 2.45 112.208 -177.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 mt -71.71 -40.54 69.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.698 0.761 . . . . 1.42 109.156 -176.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.631 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.54 -35.08 91.27 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.35 -1.296 . . . . 0.37 111.526 175.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -69.24 -42.31 75.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.64 0.257 . . . . 0.48 110.34 174.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -55.37 -53.28 58.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.967 -0.561 . . . . 2.17 110.981 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.1 -30.93 45.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 1.12 111.15 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.631 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -62.24 -58.28 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.404 -0.362 . . . . 1.7 110.224 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.586 ' O ' ' HG3' ' A' ' 69' ' ' MET . 85.7 mttt -61.56 -38.79 88.8 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.388 0.614 . . . . 3.96 110.03 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -64.77 -39.47 93.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.062 -0.972 . . . . 1.5 109.82 -179.023 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.53 -29.24 46.34 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.77 -0.65 . . . . 2.34 109.292 -175.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.19 -39.82 95.74 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.086 -0.961 . . . . 0.4 111.321 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.586 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 20.2 mtm -64.93 -46.94 79.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.429 -0.582 . . . . 0.72 109.429 177.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.499 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 94.1 t -56.71 -42.61 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 114.912 -1.04 . . . . 0.79 110.289 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -64.17 -38.87 92.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.798 -0.637 . . . . 1.47 110.811 177.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -56.89 -33.3 66.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.196 0.522 . . . . 1.26 110.382 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 69' ' ' MET . 65.4 mmtt -79.38 -49.63 12.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.6 -0.727 . . . . 1.54 110.441 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -69.37 -25.89 30.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.126 0.488 . . . . 0.34 111.514 -176.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -36.11 76.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.712 0.767 . . . . 0.35 109.698 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.47 2.82 52.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.527 -1.215 . . . . 0.49 110.536 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 132' ' ' PHE . 10.9 tp -93.33 134.23 35.75 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.567 -0.742 . . . . 0.71 109.321 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.39 153.57 46.07 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.762 -0.732 . . . . 0.76 111.838 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -43.07 -38.62 7.49 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.85 3.034 . . . . 1.56 113.657 -178.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.06 -54.3 40.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 2.52 110.315 -177.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.408 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -80.84 -28.09 36.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.817 -0.628 . . . . 0.36 110.936 -174.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 41.4 ttmt -55.32 -44.37 75.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.626 -0.715 . . . . 2.04 110.278 176.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 87' ' ' LYS . . . -59.98 -42.14 98.19 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.943 -0.646 . . . . 0.41 112.02 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -67.2 -43.87 81.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.742 0.306 . . . . 1.65 110.985 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -45.38 93.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.372 -0.376 . . . . 0.41 111.456 -177.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 33.5 mt-10 -66.42 -23.25 66.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.274 -0.421 . . . . 1.96 111.045 -177.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 83' ' ' GLY . 5.7 mptp? -87.68 -48.48 7.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.365 -0.38 . . . . 2.12 111.258 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 10.8 p -61.47 -39.55 91.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.637 0.256 . . . . 0.57 111.069 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -59.98 -45.04 95.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 1.09 110.866 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.2 -36.4 69.19 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.576 0.227 . . . . 2.82 111.323 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 95.0 mt -61.28 -52.2 64.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 0.51 110.362 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.16 77.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.64 110.801 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -60.61 -42.5 96.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.036 -0.529 . . . . 4.42 110.89 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.17 -32.58 84.64 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.008 -0.615 . . . . 0.66 111.982 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.8 mm -61.4 -49.27 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.001 0.429 . . . . 0.55 110.55 179.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -94.93 21.46 7.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.148 0.499 . . . . 2.7 110.576 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -105.23 -34.91 7.74 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.533 -0.758 . . . . 0.63 109.047 168.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.506 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 6.4 ptp180 -80.75 -15.85 55.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.946 -0.57 . . . . 3.1 109.61 175.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -65.26 -35.78 82.1 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.135 -0.691 . . . . 0.97 109.135 166.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.542 ' CD2' ' HE2' ' A' ' 37' ' ' PHE . 13.4 m-85 -75.27 -46.36 34.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.582 -0.735 . . . . 1.48 112.019 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 41.6 p -60.23 -21.82 62.28 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.865 0.691 . . . . 0.87 112.865 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.16 29.41 5.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.844 -0.693 . . . . 1.16 111.957 -174.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -132.77 68.86 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.305 -0.628 . . . . 1.83 109.305 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.63 110.68 2.54 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.898 -0.592 . . . . 1.75 111.745 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HG3' ' HG3' ' A' ' 98' ' ' ARG . 78.2 Cg_exo -50.78 148.75 15.53 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.8 3.0 . . . . 0.53 113.772 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -88.61 168.76 12.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.788 -0.819 . . . . 1.48 108.788 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.7 tppt? -59.93 -38.39 82.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.403 0.547 . . . . 2.88 109.783 -176.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.03 -31.16 72.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.972 -1.013 . . . . 2.24 111.258 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -64.15 -44.41 92.2 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.239 0.542 . . . . 1.73 109.837 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.8 mp -68.0 -44.73 75.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.82 110.789 177.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 58.4 mtpt -54.66 -46.55 74.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.392 0.615 . . . . 1.74 110.133 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.74 -43.17 94.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.47 111.723 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -64.43 -39.17 93.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.977 0.362 . . . . 1.34 111.977 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.684 ' O ' HG22 ' A' ' 117' ' ' VAL . 4.3 m -76.74 -27.96 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-O 121.671 0.748 . . . . 0.65 109.292 -178.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -62.13 -37.65 85.96 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.9 . . . . 1.72 111.036 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 120' ' ' LEU . 8.7 tt0 -77.35 -34.55 55.11 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 116.453 -0.34 . . . . 2.27 111.147 -175.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.684 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -62.02 -34.59 64.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.562 -0.455 . . . . 0.81 109.91 171.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.0 mt -72.81 -34.13 66.68 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.281 -0.266 . . . . 1.21 110.281 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -59.85 -42.45 93.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.439 0.638 . . . . 0.95 109.344 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.444 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.5 mp -73.58 -45.12 55.16 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.192 -0.913 . . . . 1.06 111.288 175.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -72.56 -30.75 64.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.99 -0.684 . . . . 1.54 111.893 -170.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.12 -35.79 81.43 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.006 0.432 . . . . 1.98 110.924 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.98 -4.68 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.896 0.702 . . . . 0.7 112.896 -173.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 55.3 mtm -75.0 154.41 38.07 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.425 -0.51 . . . . 0.5 110.902 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.8 m -64.02 140.63 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.269 -0.423 . . . . 1.18 110.446 176.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -52.64 -45.75 66.81 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.44 0.533 . . . . 2.21 112.44 -170.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -32.47 70.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.42 111.108 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.88 -34.2 53.5 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.484 -0.646 . . . . 0.31 111.484 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -67.37 -44.99 77.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.226 0.536 . . . . 1.32 110.371 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.19 -41.66 89.04 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.144 -0.935 . . . . 0.42 111.363 178.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -71.6 -26.65 62.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.05 -0.977 . . . . 0.55 110.407 -174.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.421 ' HA ' HD11 ' A' ' 77' ' ' LEU . 92.2 t80 -63.01 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.753 -0.658 . . . . 0.39 109.898 172.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -74.84 -5.45 74.85 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 121.045 -0.597 . . . . 0.27 112.92 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -94.41 -37.38 11.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.398 0.618 . . . . 2.43 109.874 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 75.1 mm-40 -90.79 -33.84 15.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.004 -0.998 . . . . 1.83 110.922 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.499 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 43.4 m-85 -133.38 72.57 74.85 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 0.69 110.471 174.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.93 -29.52 67.08 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.984 2.456 . . . . 0.63 111.774 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -64.58 -39.3 93.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.465 -0.789 . . . . 2.31 111.029 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.6 mt -81.93 -40.18 22.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.522 -0.308 . . . . 1.02 110.605 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.66 70.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.115 0.483 . . . . 0.35 110.127 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.01 -69.59 0.11 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.373 -0.83 . . . . 2.58 111.088 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.581 HG21 HD22 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -60.19 -30.71 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.071 -0.968 . . . . 0.5 112.631 -174.504 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.418 ' CD1' HG22 ' A' ' 142' ' ' VAL . 16.3 m-30 -73.65 -47.08 42.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.149 -0.621 . . . . 0.62 110.726 -175.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -74.51 -30.86 61.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.558 -0.292 . . . . 2.58 111.639 -175.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 12.4 p -73.04 -16.35 61.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.09 0.471 . . . . 1.32 110.636 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . 0.41 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 93.49 1.45 66.29 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.697 -0.763 . . . . 1.09 112.696 176.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.39 -45.67 93.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.616 0.246 . . . . 1.98 110.93 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 142' ' ' VAL . . . -66.17 -39.51 89.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.855 0.359 . . . . 0.34 110.132 176.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.66 82.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.51 111.485 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 11.7 mptt -75.19 -35.7 61.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 2.82 111.117 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 45.6 t80 -67.39 -35.43 79.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.099 0.476 . . . . 0.49 109.889 174.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.546 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -72.15 -33.8 68.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.586 -0.733 . . . . 0.59 111.216 178.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.494 0 CA-C-N 115.619 -0.719 . . . . 1.62 112.758 179.557 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . 0.618 ' CD2' ' HD3' ' A' ' 30' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.268 0.556 . . . . 1.47 110.895 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . 33.8 mmtp -116.61 146.3 42.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.734 -0.666 . . . . 3.15 109.834 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -74.47 -31.36 62.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 2.35 109.941 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -75.99 -5.51 46.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.687 -0.688 . . . . 4.16 110.439 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 2' ' ' LYS . 20.9 t70 -95.46 -16.51 22.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.002 -0.545 . . . . 2.57 109.904 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.499 ' HB ' ' HD2' ' A' ' 11' ' ' ARG . 65.1 mt -70.31 137.72 86.6 Favored Pre-proline 0 C--O 1.236 0.353 0 N-CA-C 108.961 -0.755 . . . . 0.69 108.961 175.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -42.24 116.2 0.58 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.463 . . . . 0.6 112.111 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.94 -16.75 64.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.57 112.045 -173.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.14 -30.39 60.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.835 0.826 . . . . 1.37 109.68 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -82.95 -29.37 29.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.55 -1.205 . . . . 0.8 110.849 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.499 ' HD2' ' HB ' ' A' ' 6' ' ' ILE . 45.5 mtp180 -70.8 -17.42 62.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.49 0.662 . . . . 1.73 109.952 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -72.14 -22.88 61.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.872 -1.058 . . . . 1.02 110.612 176.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.419 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 85.2 mt -89.35 -12.28 40.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.191 -0.459 . . . . 0.93 111.182 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 66.1 mtt -75.82 124.64 88.7 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.428 -0.351 . . . . 1.15 110.801 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.504 ' HD3' HD21 ' A' ' 139' ' ' LEU . 54.0 Cg_endo -71.99 153.36 57.86 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.566 2.177 . . . . 0.9 111.558 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -45.49 -53.88 5.04 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.593 2.862 . . . . 0.96 113.59 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.583 ' O ' HD21 ' A' ' 66' ' ' LEU . 44.0 mt-10 -59.87 -38.12 81.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.749 0.309 . . . . 1.83 111.585 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.47 58.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.726 0.298 . . . . 0.82 111.1 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 23.0 mtm180 -73.83 -45.03 53.78 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.161 -0.472 . . . . 2.16 110.409 177.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -47.65 -44.87 27.39 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.112 0.883 . . . . 1.06 111.473 -172.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.405 ' O ' HD23 ' A' ' 25' ' ' LEU . 38.5 t80 -59.94 -67.27 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.022 -0.535 . . . . 0.65 111.632 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.545 HD21 ' OH ' ' A' ' 100' ' ' TYR . 24.1 mt -70.61 -11.04 60.68 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.74 1.155 . . . . 1.13 112.493 -177.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.65 -40.79 88.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.257 0.551 . . . . 2.06 109.769 163.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -74.7 -48.25 26.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.346 -0.843 . . . . 1.84 112.041 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 59' ' ' LEU . 4.0 mm? -58.76 140.64 54.66 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.537 0.684 . . . . 1.05 111.852 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.2 p -139.94 -169.47 2.74 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.653 -1.158 . . . . 1.78 109.531 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.17 150.71 33.46 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.765 -0.457 . . . . 2.39 109.765 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.51 -53.8 4.38 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.501 -0.857 . . . . 0.93 111.322 -174.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 32' ' ' VAL . 16.2 m-20 -66.57 -44.78 81.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.523 0.677 . . . . 2.25 109.525 177.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.618 ' HD3' ' CD2' ' A' ' 1' ' ' PHE . 89.9 mttt -72.07 -12.58 61.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.321 -0.854 . . . . 1.31 110.664 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -76.46 -43.43 39.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.892 -0.594 . . . . 0.8 109.711 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.36 -29.93 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 115.431 -0.804 . . . . 0.85 110.498 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.642 HD23 HD21 ' A' ' 52' ' ' LEU . 23.4 mt -56.18 -42.74 77.58 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.869 0.366 . . . . 0.98 110.768 171.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 39.6 ttmt -54.56 -42.1 70.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.903 -0.59 . . . . 2.41 110.929 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.942 -0.572 . . . . 1.96 111.548 -176.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.86 -52.26 11.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.513 0.673 . . . . 0.98 109.564 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.532 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 47.5 m-85 -58.32 -50.47 73.52 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 115.223 1.564 . . . . 0.83 115.223 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 15.5 ptpt -86.54 18.04 3.53 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.42 -0.912 . . . . 2.18 111.729 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.46 -78.67 0.59 Allowed 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.509 -0.768 . . . . 1.56 109.388 169.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 44.77 -151.37 0.75 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 121.084 -0.579 . . . . 1.54 113.22 -175.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 9.3 Cg_endo -89.28 147.0 22.42 Favored 'Cis proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.986 -1.256 . . . . 1.68 111.318 -6.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.431 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 36.0 m-85 -118.02 114.05 22.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.775 -0.648 . . . . 1.28 110.566 -175.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HG3' HD22 ' A' ' 44' ' ' ASN . 13.4 ptmm? -73.19 -7.21 50.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.407 -0.815 . . . . 3.51 111.239 177.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.527 HD22 ' HG3' ' A' ' 43' ' ' LYS . 8.4 p30 -150.03 161.97 41.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.902 -0.407 . . . . 1.52 109.902 -178.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 49' ' ' ILE . 19.9 m -73.51 -28.01 61.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.289 -0.414 . . . . 1.18 110.86 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 38.2 mt-10 -59.51 -40.98 88.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 2.24 111.113 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.431 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.9 mt-10 -62.99 -35.17 79.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.738 0.304 . . . . 2.26 111.145 176.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.4 m -69.93 -40.84 75.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.156 0.503 . . . . 1.19 110.006 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 45' ' ' THR . 76.2 mt -65.08 -42.72 95.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.55 110.212 177.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.31 80.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.298 -0.864 . . . . 0.57 111.285 176.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.74 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.433 0.635 . . . . 0.5 110.258 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.642 HD21 HD23 ' A' ' 33' ' ' LEU . 36.4 mt -69.86 -36.35 75.43 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.202 -0.908 . . . . 0.45 111.395 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -65.12 -30.24 71.16 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.926 -0.31 . . . . 1.22 111.147 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -75.0 -44.37 48.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.206 0.527 . . . . 3.05 110.402 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.46 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 52.3 mmtt -68.71 -55.95 9.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.711 . . . . 1.48 111.607 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 m -142.54 95.7 6.43 Favored Pre-proline 0 C--N 1.315 -0.93 0 N-CA-C 110.214 -0.291 . . . . 1.16 110.214 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.34 -59.61 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.96 3.107 . . . . 0.58 113.95 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -66.88 -22.07 65.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.49 -0.777 . . . . 2.45 112.286 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 3.4 tt -73.85 -41.53 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.602 -1.258 . . . . 1.42 107.602 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -64.3 -33.11 86.36 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 114.264 -1.334 . . . . 0.37 111.311 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -65.42 -39.86 92.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.796 0.331 . . . . 0.48 110.272 173.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 59' ' ' LEU . 16.5 tppt? -57.0 -57.42 12.64 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.638 -0.71 . . . . 2.17 110.916 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 8.1 p -63.48 -35.65 73.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.327 -0.397 . . . . 1.12 111.246 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.26 -64.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.228 -0.442 . . . . 1.7 111.458 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HD3' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.55 -32.12 73.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.251 0.548 . . . . 3.96 110.788 -173.016 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.4 tm? -67.29 -46.54 73.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.389 -0.823 . . . . 1.5 110.143 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -24.74 57.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.911 -0.774 . . . . 2.34 108.911 -175.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.67 81.94 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.923 -1.035 . . . . 0.4 111.804 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.5 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 34.6 mtm -65.08 -50.73 65.0 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.321 -0.622 . . . . 0.72 109.321 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.482 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 89.0 t -53.7 -43.62 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 114.795 -1.093 . . . . 0.79 110.238 174.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -60.82 -40.17 91.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.311 -0.859 . . . . 1.47 110.683 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.8 m -63.3 -39.31 94.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.641 0.258 . . . . 1.26 111.048 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 69' ' ' MET . 32.9 mmtp -66.64 -43.87 83.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 1.54 110.225 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.487 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 77.9 mt -72.51 -23.44 21.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.242 0.544 . . . . 0.34 111.021 178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.14 -30.44 67.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.584 0.707 . . . . 0.35 110.184 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.85 2.91 56.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.863 -1.062 . . . . 0.49 110.761 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.505 HD13 ' CG ' ' A' ' 135' ' ' GLN . 11.5 tp -95.76 132.67 40.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.715 -0.675 . . . . 0.71 110.378 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.86 151.24 49.56 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.894 -0.67 . . . . 0.76 112.061 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -41.07 -42.83 4.84 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 124.075 3.183 . . . . 1.56 114.312 -176.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -60.53 -51.7 68.32 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.417 0.627 . . . . 2.52 110.305 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.533 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.63 -30.74 32.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.146 -0.934 . . . . 0.36 110.646 -173.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 27.7 ttpp -59.3 -44.59 92.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 2.04 110.518 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.68 -41.68 90.23 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.683 -0.77 . . . . 0.41 111.436 178.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.12 -48.84 66.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.269 . . . . 1.65 111.225 175.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.28 -45.6 76.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.167 0.508 . . . . 0.41 111.388 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.647 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 38.8 mt-10 -67.83 -43.37 79.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 1.96 110.419 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -66.35 -44.04 84.39 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.731 0.301 . . . . 2.12 111.301 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.2 p -62.77 -41.48 99.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.347 -0.388 . . . . 0.57 110.914 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.649 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 28.8 mt -64.59 -39.77 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 116.376 -0.374 . . . . 1.09 110.843 177.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.647 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.3 mt-10 -52.97 -44.26 67.02 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.969 0.414 . . . . 2.82 110.646 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 48.3 mt -69.55 -44.25 79.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.827 -0.624 . . . . 0.51 110.753 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.95 -22.55 64.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.64 111.28 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 39.2 mtm180 -63.41 -50.25 70.59 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.803 -0.443 . . . . 4.42 109.803 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.96 -35.76 92.41 Favored Glycine 0 N--CA 1.453 -0.219 0 CA-C-N 115.961 -0.563 . . . . 0.66 113.185 -172.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.4 -49.44 83.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.991 0.424 . . . . 0.55 110.664 -178.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -94.89 7.02 47.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.373 -0.376 . . . . 2.7 111.033 -179.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -86.24 -30.83 22.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.218 -0.66 . . . . 0.63 109.218 167.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.519 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 61.1 mtp180 -83.24 -7.72 59.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.749 -0.66 . . . . 3.1 109.404 174.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.471 ' CE1' ' HD2' ' A' ' 105' ' ' PRO . 8.4 m-85 -80.05 -26.13 39.84 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.084 -0.71 . . . . 0.97 109.084 166.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.545 ' OH ' HD21 ' A' ' 22' ' ' LEU . 23.1 m-85 -80.14 -49.26 11.95 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.131 -0.486 . . . . 1.48 110.723 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.534 ' HA ' ' HG3' ' A' ' 34' ' ' LYS . 55.1 p -63.97 -22.33 66.88 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.756 -0.656 . . . . 0.87 112.501 -174.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.47 11.1 45.71 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.7 -0.762 . . . . 1.16 112.715 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.519 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 58.1 t30 -111.35 66.85 0.63 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.675 -0.491 . . . . 1.83 109.675 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.77 123.21 37.66 Favored Pre-proline 0 N--CA 1.464 0.229 0 CA-C-N 115.259 -0.882 . . . . 1.75 112.35 -172.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . 0.471 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 44.9 Cg_endo -69.48 155.04 67.98 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.985 2.457 . . . . 0.53 111.995 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.455 ' O ' HD13 ' A' ' 110' ' ' LEU . 80.6 p -83.79 173.92 10.88 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.933 -0.395 . . . . 1.48 109.933 176.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -65.08 -27.67 68.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.236 0.541 . . . . 2.88 109.807 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -72.8 -29.58 63.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.877 -0.601 . . . . 2.24 110.225 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.71 -44.1 97.58 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-O 121.292 0.567 . . . . 1.73 109.642 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 106' ' ' THR . 7.0 mp -65.18 -45.13 86.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.328 -0.851 . . . . 0.82 110.939 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -58.38 -42.02 86.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.173 0.511 . . . . 1.74 110.127 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -63.5 -42.94 98.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.721 -0.672 . . . . 0.47 111.412 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.498 ' O ' HG13 ' A' ' 117' ' ' VAL . 77.5 p -63.26 -34.98 78.85 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.771 -0.372 . . . . 1.34 111.964 -178.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.611 ' O ' HG22 ' A' ' 117' ' ' VAL . 5.5 m -87.1 -27.3 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.221 0.534 . . . . 0.65 110.537 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 14.6 ptpt -71.07 -30.63 66.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.47 . . . . 1.72 110.973 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.61 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.0 mt-10 -77.5 -36.19 52.8 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 119.839 -0.744 . . . . 2.27 110.63 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.41 -28.15 42.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 120.287 -0.565 . . . . 0.81 109.68 175.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.482 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.3 mt -73.92 -38.97 64.14 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.637 -0.505 . . . . 1.21 109.637 173.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -58.65 -49.2 78.42 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.438 -0.579 . . . . 0.95 109.438 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.4 mm? -61.43 -46.81 88.54 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.662 -0.699 . . . . 1.06 112.052 173.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -32.12 64.51 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 118.513 -1.275 . . . . 1.54 111.862 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.079 0.466 . . . . 1.98 110.654 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.2 59.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.698 . . . . 0.7 112.577 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.533 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 60.6 mtm -72.71 151.03 42.4 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.662 -0.815 . . . . 0.5 110.042 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.3 p -63.43 150.32 43.9 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 1.18 110.145 173.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -55.55 -43.29 75.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.557 0.218 . . . . 2.21 111.501 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.31 -25.15 66.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.137 -0.483 . . . . 0.42 111.464 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.46 -36.1 24.34 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.87 -0.681 . . . . 0.31 111.646 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 124' ' ' MET . 98.5 mttt -63.14 -45.92 89.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.211 0.529 . . . . 1.32 110.502 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . 0.529 ' O ' ' HE3' ' A' ' 134' ' ' LYS . . . -66.89 -33.85 76.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.544 -0.753 . . . . 0.42 111.335 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -74.79 -32.26 61.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.914 0.388 . . . . 0.55 110.049 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.47 -32.36 71.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.968 -0.56 . . . . 0.39 110.088 172.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -67.14 -18.65 69.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.889 -0.596 . . . . 0.27 113.067 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.529 ' HE3' ' O ' ' A' ' 130' ' ' ALA . 23.2 mmtp -82.8 -29.37 29.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.468 0.651 . . . . 2.43 110.065 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.505 ' CG ' HD13 ' A' ' 77' ' ' LEU . 6.2 mm100 -96.23 -40.8 8.99 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.041 -0.981 . . . . 1.83 110.976 -174.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.482 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 70.5 m-85 -131.18 74.1 79.74 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.984 0.421 . . . . 0.69 109.958 176.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.8 -34.55 72.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.104 2.536 . . . . 0.63 112.621 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 47.8 t80 -64.58 -34.34 78.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.884 0.373 . . . . 2.31 110.616 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.512 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 86.6 mt -78.84 -47.43 16.63 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.845 -0.342 . . . . 1.02 110.375 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.03 -33.62 67.38 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.185 0.516 . . . . 0.35 109.777 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.553 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.8 tttp -51.09 -73.37 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.89 -1.05 . . . . 2.58 111.525 171.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 148' ' ' ALA . 1.1 m -72.17 -13.76 16.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.346 -0.843 . . . . 0.5 112.91 -171.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.2 m-30 -80.21 -44.81 19.1 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.41 -0.516 . . . . 0.62 110.259 175.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.84 -43.05 84.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.861 -0.609 . . . . 2.58 110.386 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.4 m -76.85 156.83 31.9 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.96 -0.755 . . . . 1.32 108.96 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -79.28 48.74 3.43 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.509 -0.853 . . . . 1.09 112.763 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.419 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 1.7 tmtp? -100.64 -65.87 0.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.123 -0.325 . . . . 1.98 110.123 -178.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . 0.538 ' HB2' HG23 ' A' ' 142' ' ' VAL . . . -64.86 -38.38 90.8 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.061 0.458 . . . . 0.34 109.86 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.482 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -55.55 -44.73 77.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.292 -0.867 . . . . 0.51 110.763 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.05 -38.14 82.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 2.82 110.269 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -58.43 -41.85 85.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 0.49 110.255 177.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.584 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.47 -27.99 63.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.741 -0.663 . . . . 0.59 111.769 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.691 0 N-CA-C 111.314 -0.714 . . . . 1.62 111.314 -175.254 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.469 0.652 . . . . 1.47 112.444 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -104.89 135.06 46.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.348 -0.842 . . . . 3.15 109.704 176.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.35 -39.93 94.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.08 -0.963 . . . . 2.35 112.621 -168.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -93.67 18.59 9.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.18 0.514 . . . . 4.16 111.131 -177.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -98.44 0.87 46.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.951 0.881 . . . . 2.57 109.092 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.9 mt -81.9 131.93 55.66 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.946 -1.025 . . . . 0.69 109.169 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.83 114.79 0.57 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.304 2.67 . . . . 0.6 112.349 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.65 66.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.772 -0.649 . . . . 0.57 111.481 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -65.21 -34.92 79.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.9 0.857 . . . . 1.37 109.697 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 90.7 t80 -82.81 -33.36 27.25 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.447 -1.252 . . . . 0.8 110.369 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.543 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 41.1 mtp85 -64.2 -24.86 67.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.324 0.583 . . . . 1.73 110.26 -178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -63.64 -27.02 68.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.02 110.866 176.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 mt -94.23 -19.25 20.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.93 110.971 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 91.5 mtp -65.73 131.29 94.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 1.15 111.653 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.5 Cg_exo -60.51 137.1 71.71 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.657 2.238 . . . . 0.9 111.363 176.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.3 Cg_exo -52.02 -31.24 43.35 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.618 2.878 . . . . 0.96 112.916 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -62.56 -49.5 75.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.075 0.464 . . . . 1.83 110.541 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.08 65.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 0.82 110.909 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -78.56 -44.38 24.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.786 -0.643 . . . . 2.16 111.307 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 32.2 t70 -51.71 -49.47 62.42 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.46 0.475 . . . . 1.06 112.195 -176.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' HB2' HD22 ' A' ' 66' ' ' LEU . 54.1 t80 -55.93 -58.49 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.378 -0.374 . . . . 0.65 111.728 177.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 25' ' ' LEU . 80.1 mt -72.55 -13.11 61.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.894 0.77 . . . . 1.13 111.329 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 51.7 tt0 -65.01 -49.47 70.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.688 0.28 . . . . 2.06 110.957 167.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -86.84 -30.79 21.2 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.992 0.367 . . . . 1.84 111.992 -175.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 22' ' ' LEU . 14.9 tp -67.54 131.25 45.29 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-O 121.328 0.585 . . . . 1.05 110.407 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 14.2 t -119.22 168.6 10.73 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.414 -0.812 . . . . 1.78 110.011 -172.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 0.8 OUTLIER -54.66 -44.4 73.25 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.335 0.865 . . . . 2.39 113.335 -169.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.83 -38.33 83.1 Favored Glycine 0 N--CA 1.454 -0.156 0 C-N-CA 120.833 -0.699 . . . . 0.93 111.938 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 32' ' ' VAL . 49.7 m-20 -79.61 -38.63 33.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.433 0.159 . . . . 2.25 110.626 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 26' ' ' SER . 82.1 mttt -54.65 -27.95 43.55 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.152 0.501 . . . . 1.31 110.237 176.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.404 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 74.7 m -59.36 -36.33 75.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.425 -0.807 . . . . 0.8 111.522 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 29' ' ' ASP . 6.1 p -89.22 -24.58 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 116.211 -0.45 . . . . 0.85 110.794 -174.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.64 HD13 HD21 ' A' ' 52' ' ' LEU . 4.3 mm? -50.2 -52.01 39.28 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.345 -0.389 . . . . 0.98 111.318 173.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 46.2 pttt -66.19 -21.22 66.31 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.107 0.41 . . . . 2.41 112.107 -176.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -70.71 -27.99 64.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.159 0.504 . . . . 1.96 110.184 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.96 -51.89 16.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.726 . . . . 0.98 109.967 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.54 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 49.7 m-85 -60.71 -45.76 92.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.899 1.444 . . . . 0.83 114.899 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.9 -20.95 60.24 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.012 -0.675 . . . . 2.18 110.504 -177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.23 -76.6 0.13 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.903 -0.59 . . . . 1.56 109.907 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.405 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 48.32 -158.38 0.83 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.077 -0.582 . . . . 1.54 112.693 -176.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -95.03 138.01 5.9 Favored 'Cis proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.184 -1.173 . . . . 1.68 111.175 -9.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 41.7 m-85 -114.27 108.18 16.59 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.56 0.695 . . . . 1.28 110.916 -173.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.45 -8.93 29.33 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.435 -1.257 . . . . 3.51 111.0 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -137.79 163.54 31.11 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.617 -0.883 . . . . 1.52 108.617 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.9 m -85.33 -33.29 22.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.797 0.332 . . . . 1.18 110.379 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.449 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.1 mp0 -56.61 -34.28 67.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 2.24 111.702 179.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.6 OUTLIER -68.57 -38.07 80.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.74 0.305 . . . . 2.26 111.242 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.5 m -66.52 -39.34 88.57 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.507 -0.553 . . . . 1.19 109.507 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 64' ' ' GLU . 97.0 mt -61.79 -44.66 99.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.254 -0.885 . . . . 0.55 110.108 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.77 -48.69 80.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.57 111.861 176.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.48 87.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.304 0.573 . . . . 0.5 110.214 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.64 HD21 HD13 ' A' ' 33' ' ' LEU . 29.0 mt -66.49 -38.06 86.44 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.184 -0.916 . . . . 0.45 111.331 178.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.27 -39.44 92.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.838 0.351 . . . . 1.22 111.547 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -71.24 -44.62 64.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.41 -0.359 . . . . 3.05 111.123 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HB3' HG21 ' A' ' 32' ' ' VAL . 25.3 mmtt -68.73 -48.79 62.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.125 -0.489 . . . . 1.48 111.931 177.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.2 m -145.4 96.9 4.78 Favored Pre-proline 0 C--N 1.313 -1.004 0 O-C-N 122.234 -0.291 . . . . 1.16 110.502 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -41.8 -56.79 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.809 3.006 . . . . 0.58 113.209 -170.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.475 ' HG2' ' HE3' ' A' ' 62' ' ' LYS . 37.0 tt0 -60.21 -35.41 75.36 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.533 -1.212 . . . . 2.45 112.436 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 29' ' ' ASP . 62.1 mt -69.6 -40.61 76.56 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 119.406 -0.917 . . . . 1.42 109.05 -175.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.73 -38.43 96.18 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 114.311 -1.313 . . . . 0.37 111.691 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.9 95.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.745 0.307 . . . . 0.48 110.49 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HE3' ' HG2' ' A' ' 58' ' ' GLU . 98.7 mttt -62.45 -58.73 6.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.013 -0.539 . . . . 2.17 110.913 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 11.5 p -62.88 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 1.12 111.425 -177.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.525 ' HA ' HD13 ' A' ' 49' ' ' ILE . 38.3 tt0 -67.0 -57.73 6.3 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 121.011 -0.276 . . . . 1.7 111.016 178.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' MET . 0.1 OUTLIER -64.67 -31.19 72.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.619 0.723 . . . . 3.96 109.706 -175.468 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.562 HD22 ' HB2' ' A' ' 21' ' ' PHE . 21.5 tp -67.79 -38.15 82.95 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.707 -1.133 . . . . 1.5 110.49 177.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -79.36 -31.65 43.02 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.974 -0.75 . . . . 2.34 108.974 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.42 95.45 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.851 -1.068 . . . . 0.4 111.138 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 43.9 mtm -58.79 -55.72 31.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.892 -0.41 . . . . 0.72 109.892 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 66' ' ' LEU . 95.2 t -50.93 -46.82 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 115.366 -0.834 . . . . 0.79 110.949 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 12.8 mtpt -66.17 -33.92 76.86 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.662 -0.699 . . . . 1.47 112.308 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.4 t -56.6 -41.56 77.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.086 0.47 . . . . 1.26 110.649 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 3.9 mptp? -69.6 -45.33 68.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.963 -0.562 . . . . 1.54 110.061 177.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -67.94 -25.27 31.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.221 0.534 . . . . 0.34 110.889 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.27 -33.77 73.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.709 0.766 . . . . 0.35 109.939 173.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.01 -1.94 58.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.741 -1.118 . . . . 0.49 110.83 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.9 tp -93.95 137.97 32.58 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.731 -0.668 . . . . 0.71 109.894 -175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.97 149.28 51.46 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.393 -0.67 . . . . 0.76 112.037 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -37.95 -42.85 1.48 Allowed 'Trans proline' 0 N--CA 1.478 0.603 0 C-N-CA 124.666 3.577 . . . . 1.56 114.741 -176.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -70.14 -51.37 31.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.552 0.215 . . . . 2.52 110.683 -177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.49 -33.46 69.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.711 0.767 . . . . 0.36 109.825 -177.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -57.2 -45.92 83.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.401 -1.272 . . . . 2.04 110.927 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.24 97.93 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.654 -0.784 . . . . 0.41 111.738 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.526 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 6.5 t80 -62.49 -48.02 81.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.359 -0.237 . . . . 1.65 110.359 175.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.691 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -56.83 -56.95 14.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.274 . . . . 0.41 111.385 -178.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 30.3 mt-10 -62.7 -25.13 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 1.96 111.408 -174.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.451 ' O ' HG13 ' A' ' 91' ' ' ILE . 53.5 tttp -86.75 -41.46 14.11 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.641 -0.254 . . . . 2.12 111.05 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.8 p -66.75 -39.47 87.92 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.683 -0.235 . . . . 0.57 111.158 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 85' ' ' ALA . 51.7 mm -58.12 -40.14 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 110.077 -0.342 . . . . 1.09 110.077 176.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 75.5 mm-40 -63.61 -34.49 77.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.11 -0.495 . . . . 2.82 111.246 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 87' ' ' LYS . 53.2 mt -65.82 -49.6 76.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.777 0.323 . . . . 0.51 110.482 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.92 -36.01 79.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.683 -0.488 . . . . 0.64 109.683 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -56.91 -40.62 76.62 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.468 -0.787 . . . . 4.42 110.763 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.86 -36.47 82.03 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.899 -0.667 . . . . 0.66 112.46 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 110' ' ' LEU . 45.4 mm -67.62 -49.59 68.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.256 0.551 . . . . 0.55 110.071 178.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.7 ptmm? -80.68 2.37 26.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 2.7 111.131 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.66 -26.37 27.83 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.89 -0.782 . . . . 0.63 108.89 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.1 mtp180 -86.86 -1.56 57.89 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 3.1 109.866 174.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -90.84 -22.11 21.13 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.909 -0.404 . . . . 0.97 109.909 165.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.564 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 30.8 m-85 -84.82 -45.04 12.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.96 0.409 . . . . 1.48 110.731 176.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.57 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 16.7 p -70.17 -20.97 63.1 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.005 0.743 . . . . 0.87 113.005 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 98.28 1.47 58.07 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.762 -0.733 . . . . 1.16 112.789 -174.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASN . . . . . 0.625 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 51.3 m-80 -92.64 56.97 2.8 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 122.706 -0.29 . . . . 1.83 110.732 -178.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -43.72 123.21 3.81 Favored Pre-proline 0 N--CA 1.469 0.476 0 O-C-N 124.128 0.893 . . . . 1.75 112.374 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.0 155.52 38.4 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.946 2.431 . . . . 0.53 112.177 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -94.17 177.95 5.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.96 -0.756 . . . . 1.48 108.96 173.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.0 ptpp? -62.77 -31.14 72.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.036 -0.666 . . . . 2.88 110.86 -175.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -61.81 -38.28 87.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.605 -0.271 . . . . 2.24 110.777 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -63.54 -45.0 92.55 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.28 0.562 . . . . 1.73 110.3 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 95' ' ' ILE . 40.4 mt -67.24 -41.93 84.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.296 -0.865 . . . . 0.82 110.895 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 59.1 mtpt -60.98 -41.75 97.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.973 0.416 . . . . 1.74 110.021 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.55 -39.44 93.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.939 -0.573 . . . . 0.47 111.291 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 117' ' ' VAL . 73.7 p -66.28 -33.6 76.11 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.392 0.515 . . . . 1.34 112.392 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.58 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.2 m -85.85 -25.81 6.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.868 0.842 . . . . 0.65 109.404 -179.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 10.3 ttpt -61.5 -46.11 91.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.589 -1.187 . . . . 1.72 111.405 -178.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.491 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.1 mt-10 -73.01 -33.88 66.03 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.666 -0.414 . . . . 2.27 111.793 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.5 m -64.13 -34.67 70.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.235 -0.586 . . . . 0.81 110.457 178.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.43 ' CD2' ' HB2' ' A' ' 149' ' ' ALA . 5.0 mp -76.79 -30.01 56.26 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.281 -0.568 . . . . 1.21 110.471 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -62.07 -38.21 87.92 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.168 -0.679 . . . . 0.95 109.168 178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.1 mp -76.74 -47.5 21.61 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.234 -0.894 . . . . 1.06 111.925 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.526 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 12.9 t80 -72.76 -39.48 66.76 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.469 -0.493 . . . . 1.54 111.938 -168.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -65.42 -36.66 84.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.368 0.604 . . . . 1.98 110.142 178.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.57 -2.1 24.43 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.7 -1.136 . . . . 0.7 112.99 -176.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 74.0 mtm -78.63 153.05 31.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.494 -0.928 . . . . 0.5 108.494 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -53.43 -79.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.402 0.546 . . . . 1.18 111.083 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.502 ' HA ' ' HG2' ' A' ' 129' ' ' LYS . 24.0 t70 -168.78 -47.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.358 -0.214 . . . . 2.21 110.956 175.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.56 74.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.264 -0.425 . . . . 0.42 110.855 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.18 -40.75 28.45 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.444 -0.798 . . . . 0.31 112.685 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 126' ' ' ASP . 4.5 ptpp? -70.81 -35.96 72.76 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.345 -0.542 . . . . 1.32 110.528 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.94 -23.43 60.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.42 110.699 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . 0.469 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 35.6 t70 -78.86 -32.33 45.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.55 109.653 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.39 -28.26 69.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.491 -0.777 . . . . 0.39 109.855 173.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.39 -16.73 69.68 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.27 113.211 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 64.8 mttt -86.34 -40.31 15.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 121.628 0.728 . . . . 2.43 109.643 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 1.8 mp0 -78.44 -43.45 27.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.753 -1.112 . . . . 1.83 111.281 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' PHE . . . . . 0.444 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 65.7 m-85 -128.1 77.32 76.89 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.69 110.025 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.36 -36.5 44.71 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.319 2.68 . . . . 0.63 113.333 -172.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' PHE . . . . . 0.576 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 52.3 t80 -62.41 -40.77 97.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 2.31 111.373 -175.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 143' ' ' PHE . 92.2 mt -75.2 -45.6 39.41 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.855 -0.338 . . . . 1.02 110.651 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.88 71.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.35 110.291 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.9 tttt -52.42 -72.08 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 2.58 111.175 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.575 ' HB ' ' CB ' ' A' ' 147' ' ' LYS . 2.4 m -64.56 -31.71 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.195 -0.911 . . . . 0.5 113.004 -171.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 139' ' ' LEU . 21.3 m-30 -63.88 -29.05 70.27 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.983 0.421 . . . . 0.62 110.92 -177.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -91.19 -12.19 36.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.499 . . . . 2.58 111.558 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 26.4 t -118.24 46.88 1.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.19 0.519 . . . . 1.32 110.098 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 69.68 -99.6 0.68 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.9 -0.667 . . . . 1.09 111.607 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' LYS . . . . . 0.575 ' CB ' ' HB ' ' A' ' 142' ' ' VAL . 31.2 mmtm 48.12 -95.54 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 113.064 0.764 . . . . 1.98 113.064 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.24 90.38 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.054 0.454 . . . . 0.34 110.395 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 118' ' ' LEU . . . -64.1 -43.14 96.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.51 110.295 176.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -66.26 -35.87 81.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.241 0.543 . . . . 2.82 110.176 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 56.6 t80 -62.29 -38.11 88.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.345 -0.843 . . . . 0.49 110.722 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ALA . . . . . 0.425 ' HB2' ' CG2' ' A' ' 114' ' ' VAL . . . -94.01 6.25 49.11 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.734 -0.666 . . . . 0.59 111.985 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.945 -1.262 . . . . 1.62 109.945 -175.403 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 20.2 ptp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.532 0.206 . . . . 23.59 110.593 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 134.54 -160.41 24.2 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.814 -0.707 . . . . 22.47 112.463 176.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 9.8 p -68.07 -13.16 61.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 122.545 0.338 . . . . 21.51 111.709 -178.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 7.5 p -68.21 -20.59 64.85 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.967 0.413 . . . . 20.19 110.853 178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -92.02 8.03 39.55 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.553 0.692 . . . . 21.42 109.35 177.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -111.98 -173.55 2.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 18.2 109.779 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -61.22 153.46 26.13 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.805 0.336 . . . . 16.06 110.425 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . 0.437 ' O ' ' HB2' ' A' ' -6' ' ' HIS . 55.6 m-70 -112.52 153.44 27.46 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.297 -0.631 . . . . 13.27 109.297 177.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' -7' ' ' HIS . 44.4 m170 72.01 126.91 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.659 0 O-C-N 123.755 0.66 . . . . 12.33 111.189 -176.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -152.77 -35.96 0.11 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.181 -0.463 . . . . 11.33 110.972 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 15.3 m -123.7 12.87 9.26 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.95 -0.3 . . . . 7.95 111.318 -178.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.3 m -136.18 10.8 3.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.731 0.3 . . . . 7.36 111.484 -178.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -108.04 -39.49 1.83 Allowed Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.335 -0.936 . . . . 4.57 112.529 -178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 38.3 p-80 -68.79 122.79 19.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 4.52 110.696 -178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.452 ' HG2' ' OD2' ' A' ' 27' ' ' ASP . 36.8 tpp -143.25 126.64 16.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.632 -0.713 . . . . 2.0 110.487 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.539 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 18.4 t80 -56.27 128.12 34.18 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.277 -0.874 . . . . 1.47 112.221 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -123.27 124.18 42.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.662 -0.699 . . . . 3.15 109.343 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.412 ' CD1' HD12 ' A' ' 6' ' ' ILE . 56.8 t80 -67.77 -17.61 64.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.276 0.56 . . . . 2.35 110.513 -175.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -82.59 -9.02 59.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.404 -0.816 . . . . 4.16 110.337 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -97.87 -7.63 29.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.074 -0.512 . . . . 2.57 110.799 -177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.412 HD12 ' CD1' ' A' ' 3' ' ' TYR . 52.5 mt -75.47 135.88 71.95 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.295 -0.632 . . . . 0.69 109.295 177.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.96 112.11 0.35 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.658 2.239 . . . . 0.6 111.508 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.4 -22.21 66.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.57 112.005 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.76 -30.88 71.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 122.023 0.916 . . . . 1.37 109.533 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -88.81 -26.25 21.79 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.037 -1.438 . . . . 0.8 110.736 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -72.96 -19.58 61.21 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.681 0.753 . . . . 1.73 109.5 178.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -72.03 -23.74 61.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.694 -1.139 . . . . 1.02 110.421 172.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.534 HD21 ' CD ' ' A' ' 147' ' ' LYS . 86.8 mt -94.5 17.69 12.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.852 -0.613 . . . . 0.93 112.046 -175.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.454 ' SD ' ' HG2' ' A' ' 19' ' ' ARG . 19.4 ptp -128.08 145.16 54.29 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 120.795 -0.362 . . . . 1.15 110.046 177.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.469 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 31.9 Cg_exo -59.65 140.33 93.11 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.986 2.457 . . . . 0.9 112.316 -176.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.88 -34.18 90.84 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 123.964 3.11 . . . . 0.96 112.692 -175.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -64.56 -39.38 93.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.619 -0.718 . . . . 1.83 110.366 178.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.22 -4.41 50.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.82 110.755 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 31.7 mtm180 -98.45 -38.77 9.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.986 -0.552 . . . . 2.16 110.162 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -48.78 -42.74 36.74 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 123.899 0.75 . . . . 1.06 111.275 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -56.76 -54.84 41.61 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.533 -0.758 . . . . 0.65 112.132 175.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.588 HD21 ' OH ' ' A' ' 100' ' ' TYR . 65.5 mt -79.53 -10.71 59.85 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.203 0.91 . . . . 1.13 111.266 -177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -67.26 -45.72 75.83 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.125 0.488 . . . . 2.06 110.795 162.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -88.81 -26.48 21.67 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.752 0.649 . . . . 1.84 112.752 -172.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.518 HD23 ' CD2' ' A' ' 22' ' ' LEU . 4.8 tp -77.11 136.59 38.63 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-O 121.209 0.528 . . . . 1.05 110.431 -174.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 4.9 p -120.55 -179.18 3.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.525 -0.761 . . . . 1.78 111.738 -171.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.452 ' OD2' ' HG2' ' A' ' 0' ' ' MET . 1.5 m-20 -51.45 -52.17 48.62 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.955 0.724 . . . . 2.39 112.955 -172.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -54.87 -42.05 78.21 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 116.226 -0.443 . . . . 0.93 113.31 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.669 ' O ' HG12 ' A' ' 32' ' ' VAL . 20.8 m-20 -80.86 -36.16 31.75 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 122.795 -0.238 . . . . 2.25 111.169 -179.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HA ' HD23 ' A' ' 33' ' ' LEU . 96.8 mttt -55.86 -34.03 65.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.325 0.583 . . . . 1.31 110.448 177.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.7 m -55.53 -36.56 66.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.01 -0.996 . . . . 0.8 112.145 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -88.34 -21.47 6.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 111.978 0.362 . . . . 0.85 111.978 -171.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.45 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -52.99 -48.06 67.78 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.681 0.277 . . . . 0.98 111.193 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.4 pttm -64.22 -27.68 69.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.338 -0.392 . . . . 2.41 111.184 -175.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -68.52 -37.21 79.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.047 0.451 . . . . 1.96 110.052 178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 93.4 t -72.62 -48.97 44.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.71 -0.677 . . . . 0.98 110.104 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.618 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 32.3 m-85 -57.0 -52.67 64.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.462 1.282 . . . . 0.83 114.462 176.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -74.63 -20.4 59.92 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.286 -0.566 . . . . 2.18 111.574 -171.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.64 -74.93 0.21 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.484 -0.325 . . . . 1.56 110.255 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.473 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.89 -157.16 1.19 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 121.017 -0.611 . . . . 1.54 112.968 -176.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -95.95 153.58 10.61 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 CA-C-N 118.536 1.168 . . . . 1.68 112.001 -7.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.473 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 27.7 m-85 -122.3 120.69 34.82 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.492 -0.776 . . . . 1.28 111.137 -171.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -73.61 -8.16 54.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.149 -0.932 . . . . 3.51 110.554 175.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -160.19 163.81 33.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.018 -0.734 . . . . 1.52 109.018 -176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.3 m -77.8 -22.77 49.58 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.776 -0.193 . . . . 1.18 111.509 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.83 -36.0 77.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.818 0.342 . . . . 2.24 110.421 178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 14.6 mm-40 -57.71 -40.85 80.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.136 0.493 . . . . 2.26 110.787 173.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.3 t -70.97 -36.05 72.37 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.772 -0.649 . . . . 1.19 109.846 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 65.8 mt -63.76 -44.87 98.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.286 0.565 . . . . 0.55 109.745 176.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.56 -48.7 80.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.021 -0.991 . . . . 0.57 111.159 175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.55 -40.65 87.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.324 0.583 . . . . 0.5 110.273 178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.45 HD21 HD13 ' A' ' 33' ' ' LEU . 36.5 mt -67.65 -38.24 83.52 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.307 -0.861 . . . . 0.45 111.057 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -63.52 -31.11 72.17 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.086 0.469 . . . . 1.22 110.995 177.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -75.15 -46.8 31.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 3.05 110.946 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -82.79 -37.41 24.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.178 -0.465 . . . . 1.48 112.237 -175.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.7 t -144.49 87.95 7.42 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 109.472 -0.566 . . . . 1.16 109.472 176.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -41.42 -60.55 0.63 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 124.201 3.268 . . . . 0.58 113.9 -170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.55 -34.53 74.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.117 -0.947 . . . . 2.45 111.969 -178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.423 HD22 ' HB3' ' A' ' 29' ' ' ASP . 39.2 tp -68.94 -36.81 78.4 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.061 -0.718 . . . . 1.42 109.061 -175.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.51 -35.34 91.92 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 114.664 -1.153 . . . . 0.37 111.668 175.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.99 -35.8 69.57 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.116 0.484 . . . . 0.48 110.384 175.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -64.2 -44.26 92.49 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.726 -0.67 . . . . 2.17 111.08 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 16.5 m -74.71 -30.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 C-N-CA 120.944 -0.302 . . . . 1.12 110.765 176.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -59.67 -58.89 6.6 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.256 -0.429 . . . . 1.7 110.77 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 69' ' ' MET . 82.7 tttt -57.49 -37.49 73.02 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.476 0.655 . . . . 3.96 110.254 -176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 70' ' ' VAL . 3.4 tm? -65.89 -45.69 81.11 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.02 -0.991 . . . . 1.5 109.958 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -78.3 -30.75 48.52 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.113 -0.699 . . . . 2.34 109.113 -172.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.78 -45.51 94.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.155 -0.929 . . . . 0.4 111.534 176.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.512 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 53.1 mtm -59.61 -48.36 81.95 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.381 0.61 . . . . 0.72 109.873 176.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 66' ' ' LEU . 96.4 t -54.88 -45.53 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 114.915 -1.039 . . . . 0.79 110.611 177.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.7 mmmt -63.61 -38.12 89.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.63 -0.714 . . . . 1.47 111.663 177.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.0 m -61.03 -37.48 82.74 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.082 0.468 . . . . 1.26 110.791 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.0 mttm -73.47 -48.17 35.56 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.833 -0.621 . . . . 1.54 110.003 176.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.52 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 81.1 mt -62.08 -20.62 24.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.665 0.745 . . . . 0.34 110.678 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.41 -27.81 61.66 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.394 -0.821 . . . . 0.35 109.793 177.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -91.35 0.79 57.46 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.402 -1.272 . . . . 0.49 110.279 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 77' ' ' LEU . 7.6 tp -96.02 140.34 30.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.726 -0.67 . . . . 0.71 110.634 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.86 160.21 53.18 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.998 -0.62 . . . . 0.76 112.158 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -48.04 -42.96 31.59 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.929 3.086 . . . . 1.56 113.657 -174.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.13 -45.19 74.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.601 -0.272 . . . . 2.52 110.966 -177.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.87 -30.83 40.35 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.002 -0.679 . . . . 0.36 110.297 -176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 41.1 ttmt -62.78 -40.72 98.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.625 -0.716 . . . . 2.04 110.704 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.5 -36.93 93.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.878 -0.677 . . . . 0.41 111.869 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -68.55 -46.5 69.31 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.816 -0.192 . . . . 1.65 110.545 174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.78 -55.24 36.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.74 0.305 . . . . 0.41 111.547 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -84.26 39.46 0.72 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.171 0.51 . . . . 1.96 110.691 -176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.547 ' O ' HG13 ' A' ' 91' ' ' ILE . 61.1 tttp -149.51 -43.27 0.14 Allowed 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 115.681 -0.69 . . . . 2.12 109.285 174.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 43.7 p -67.31 -44.2 79.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.335 -0.393 . . . . 0.57 110.156 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 61.0 mt -64.06 -32.97 59.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 CA-C-N 116.109 -0.496 . . . . 1.09 110.183 176.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -60.79 -35.72 77.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.968 0.413 . . . . 2.82 110.069 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 87' ' ' LYS . 54.1 mt -72.22 -50.59 35.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.016 -0.538 . . . . 0.51 110.027 176.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.84 99.77 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.862 -0.608 . . . . 0.64 111.484 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -66.03 -37.08 84.97 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.749 -0.659 . . . . 4.42 110.006 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.38 -31.9 81.01 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 121.096 -0.573 . . . . 0.66 111.916 -178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 30.8 mm -62.99 -53.54 45.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.063 0.459 . . . . 0.55 110.667 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.508 ' HD2' HD11 ' A' ' 22' ' ' LEU . 55.7 pttt -84.36 3.44 35.82 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.204 -0.453 . . . . 2.7 110.904 -178.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.618 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -91.5 -34.56 14.74 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.779 -0.452 . . . . 0.63 109.779 170.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.498 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 7.3 ptp180 -83.68 -3.59 57.89 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.261 -0.644 . . . . 3.1 109.261 174.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.539 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.2 m-85 -79.33 -34.42 42.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.709 -0.478 . . . . 0.97 109.709 164.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.593 ' HD2' ' CE2' ' A' ' 37' ' ' PHE . 22.9 m-85 -67.62 -44.92 76.87 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.373 0.606 . . . . 1.48 110.642 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.472 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.6 p -66.22 -21.93 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.078 -0.964 . . . . 0.87 112.675 -174.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.75 1.03 56.36 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.871 -0.681 . . . . 1.16 112.067 -174.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -93.6 56.88 2.46 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.878 0.37 . . . . 1.83 110.02 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -55.7 119.36 24.76 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 115.495 -0.775 . . . . 1.75 111.98 -172.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.498 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 36.8 Cg_endo -67.38 146.81 76.28 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.409 2.739 . . . . 0.53 112.543 -178.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -77.32 168.27 20.32 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.777 -0.453 . . . . 1.48 109.777 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -56.77 -32.65 65.84 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.473 0.654 . . . . 2.88 111.163 -175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -83.28 -14.57 52.82 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.561 -0.745 . . . . 2.24 111.468 -175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 105' ' ' PRO . 12.2 t70 -68.04 -40.96 82.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.608 -0.515 . . . . 1.73 109.608 174.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.69 -30.75 71.77 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.554 -0.748 . . . . 0.82 110.985 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -59.75 -46.55 88.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.607 -0.516 . . . . 1.74 109.607 176.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.04 82.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.067 -0.97 . . . . 0.47 110.821 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.454 ' OG ' HG22 ' A' ' 91' ' ' ILE . 33.5 t -53.38 -60.54 3.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 1.34 111.478 177.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.813 HG23 ' HB2' ' A' ' 152' ' ' ALA . 16.2 m -76.19 -24.02 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-O 121.014 0.435 . . . . 0.65 110.824 -172.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 155' ' ' ASN . 25.3 ttmm -54.94 -45.57 74.86 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.865 -0.607 . . . . 1.72 110.758 178.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.509 ' O ' HD13 ' A' ' 120' ' ' LEU . 31.7 mt-10 -75.03 -31.99 61.48 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.313 -0.555 . . . . 2.27 111.108 -178.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.597 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.3 m -65.29 -32.67 59.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 C-N-CA 119.647 -0.821 . . . . 0.81 109.92 177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 149' ' ' ALA . 83.0 mt -75.35 -36.4 61.0 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.878 -0.416 . . . . 1.21 109.878 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.406 ' HA ' ' OD1' ' A' ' 155' ' ' ASN . 36.5 ttpt -60.13 -38.09 82.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.467 0.651 . . . . 0.95 109.486 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.509 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -78.7 -44.51 23.41 Favored 'General case' 0 N--CA 1.438 -1.025 0 CA-C-N 115.136 -0.938 . . . . 1.06 112.073 174.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -72.91 -32.44 65.33 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 119.476 -0.89 . . . . 1.54 111.759 -169.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp -66.78 -32.73 74.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.084 0.469 . . . . 1.98 110.632 177.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.85 -9.52 59.28 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.775 0.657 . . . . 0.7 112.775 -174.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.0 mtm -75.07 154.7 37.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.317 -0.553 . . . . 0.5 110.608 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.3 m -64.4 143.72 57.69 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 110.11 -0.33 . . . . 1.18 110.11 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.68 -45.93 63.63 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.317 0.488 . . . . 2.21 112.317 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.97 -33.34 73.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.89 0.376 . . . . 0.42 111.032 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -75.03 -35.24 50.33 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 111.536 -0.626 . . . . 0.31 111.536 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.65 -43.13 94.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.197 0.522 . . . . 1.32 109.617 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.57 -29.86 66.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.53 -0.759 . . . . 0.42 111.467 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -75.19 -30.62 60.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.071 0.462 . . . . 0.55 109.803 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.413 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.8 t80 -61.65 -27.21 68.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.87 -0.604 . . . . 0.39 110.162 172.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.82 -3.35 73.45 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.942 -0.646 . . . . 0.27 113.052 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -96.54 -39.94 9.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.481 0.657 . . . . 2.43 109.915 179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -86.39 -32.42 20.94 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.884 -1.053 . . . . 1.83 110.634 -178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.458 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 53.1 m-85 -136.24 73.1 58.23 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.994 0.426 . . . . 0.69 110.951 174.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -60.99 -36.72 81.41 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 123.287 2.658 . . . . 0.63 112.942 -177.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 38.2 t80 -61.71 -40.08 93.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.508 -0.314 . . . . 2.31 110.878 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 91.3 mt -77.37 -43.22 33.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.351 -0.386 . . . . 1.02 110.604 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.07 -40.07 73.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.087 0.47 . . . . 0.35 109.947 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.471 ' HE3' ' HA ' ' A' ' 141' ' ' LYS . 0.0 OUTLIER -44.95 -68.06 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.955 -1.02 . . . . 2.58 111.613 173.449 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.508 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 1.0 OUTLIER -65.0 -22.77 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-N 115.229 -0.896 . . . . 0.5 112.132 -174.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -78.99 -38.92 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.191 -0.604 . . . . 0.62 110.739 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 49.6 mt-10 -71.09 -43.85 66.88 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.908 0.385 . . . . 2.58 110.316 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.0 m -69.78 -20.0 63.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.742 -0.663 . . . . 1.32 111.059 -179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 86.07 15.34 65.09 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.767 -0.73 . . . . 1.09 112.583 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.534 ' CD ' HD21 ' A' ' 13' ' ' LEU . 0.7 OUTLIER -63.02 -42.92 99.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.491 -0.559 . . . . 1.98 109.491 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -69.93 -32.75 71.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.34 110.298 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.505 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -60.84 -41.67 96.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.839 -0.618 . . . . 0.51 111.052 178.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -71.38 -8.97 57.26 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.842 0.353 . . . . 2.82 111.512 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -93.99 -40.53 10.06 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.945 0.402 . . . . 0.49 109.953 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.813 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.18 -24.59 51.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.823 -0.626 . . . . 0.59 112.362 -178.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 93.09 32.84 7.62 Favored Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 110.012 -1.235 . . . . 1.62 110.012 -169.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.09 84.21 0.1 Allowed 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.971 0.908 . . . . 4.12 110.829 -176.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.628 ' O ' ' HG3' ' A' ' 115' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--O 1.245 0.848 0 CA-C-N 115.028 -0.987 . . . . 4.01 109.483 -174.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.701 0.286 . . . . 23.59 110.91 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 80.79 -102.34 2.12 Favored Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 111.156 -0.778 . . . . 22.47 111.156 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 46.5 m -81.57 93.33 6.68 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.918 0.39 . . . . 21.51 110.046 175.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 17.6 m -68.48 -63.67 1.01 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.073 -0.512 . . . . 20.19 109.839 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 44.25 60.66 2.7 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.06 -0.973 . . . . 21.42 112.146 178.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -135.42 139.94 44.53 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.046 -0.724 . . . . 18.2 109.046 174.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . 0.468 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 9.2 p80 -114.11 -27.54 7.63 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.081 0.771 . . . . 16.06 113.081 -167.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -82.46 20.39 1.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.223 -0.591 . . . . 13.27 111.993 -171.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -99.34 -27.27 13.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.474 -0.33 . . . . 12.33 110.81 178.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -100.05 121.07 40.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.188 0.518 . . . . 11.33 111.532 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.7 m -158.57 80.37 0.81 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.731 -0.668 . . . . 7.95 109.634 176.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.5 p -94.17 -13.81 26.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.902 0.382 . . . . 7.36 111.483 -177.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 156.81 -25.41 0.5 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.604 -0.808 . . . . 4.57 111.945 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 82.2 m-70 -87.06 137.63 32.18 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.856 -0.794 . . . . 4.52 108.856 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 1.1 pmm? -78.03 -166.83 0.87 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.495 -0.321 . . . . 2.0 110.985 -176.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -53.73 151.82 5.88 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.364 0.602 . . . . 1.47 111.705 -176.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.449 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 71.8 mmtt -111.14 171.88 7.21 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.712 -0.676 . . . . 3.15 109.369 174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 75.7 t80 -61.81 -50.44 72.28 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.153 0.502 . . . . 2.35 109.971 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.41 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 9.5 pt-20 -74.3 -6.43 47.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 4.16 111.883 179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.468 ' OD1' ' HB2' ' A' ' -8' ' ' HIS . 11.7 t70 -78.88 -29.61 44.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.294 -0.632 . . . . 2.57 109.294 -177.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.8 mt -69.31 135.6 88.9 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.625 -0.716 . . . . 0.69 109.093 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -45.46 119.72 2.81 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 123.259 2.639 . . . . 0.6 112.28 -178.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.24 -18.66 65.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.605 -0.725 . . . . 0.57 112.123 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.68 -33.72 75.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.984 0.897 . . . . 1.37 109.251 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -82.61 -29.32 30.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 113.99 -1.459 . . . . 0.8 111.26 -176.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.433 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 18.5 mtm180 -71.98 -18.08 62.01 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.455 0.645 . . . . 1.73 109.483 -178.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.61 -27.24 63.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.727 -1.124 . . . . 1.02 110.634 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.479 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 71.8 mt -77.26 -51.54 10.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.976 -0.557 . . . . 0.93 111.385 -176.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.447 ' HA ' ' HD3' ' A' ' 15' ' ' PRO . 25.3 ptt? -75.3 136.9 71.83 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 1.15 111.515 -174.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 31.7 Cg_exo -59.68 159.8 23.16 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.534 2.823 . . . . 0.9 112.957 -177.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -53.34 -31.41 56.87 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 123.55 2.833 . . . . 0.96 112.952 -178.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.518 ' O ' HD21 ' A' ' 66' ' ' LEU . 43.8 mt-10 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.816 0.341 . . . . 1.83 110.564 177.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -21.32 66.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.319 -0.401 . . . . 0.82 111.187 -178.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 11' ' ' ARG . 20.0 mtm180 -88.39 -31.18 18.98 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.955 -0.566 . . . . 2.16 110.715 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -52.15 -51.23 59.28 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.99 -0.55 . . . . 1.06 111.262 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.564 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.6 t80 -55.41 -61.56 2.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.085 -0.507 . . . . 0.65 111.627 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 59.9 mt -74.46 -9.19 58.35 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 119.108 0.867 . . . . 1.13 111.944 -176.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -69.35 -40.24 77.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.192 0.52 . . . . 2.06 109.989 163.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.88 -47.11 40.41 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.446 -0.797 . . . . 1.84 111.074 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.612 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.9 mm? -59.85 141.54 55.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.4 0.619 . . . . 1.05 111.202 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.6 t -116.14 -63.76 1.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.78 110.314 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -176.02 -47.83 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.134 0.271 . . . . 2.39 111.432 -178.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -68.61 -34.64 79.1 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.519 -0.848 . . . . 0.93 111.305 179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.04 -36.93 69.77 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.207 0.527 . . . . 2.25 109.946 173.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' NZ ' ' HA ' ' A' ' 2' ' ' LYS . 88.5 mttt -61.64 -26.88 68.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.329 -0.85 . . . . 1.31 111.61 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 21.7 m -64.64 -35.67 81.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.157 -0.474 . . . . 0.8 110.35 177.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 35.6 t -66.27 -41.03 88.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.975 -0.557 . . . . 0.85 110.715 177.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.582 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 4.4 mm? -56.77 -46.27 81.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.915 0.388 . . . . 0.98 110.417 175.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -55.88 -43.21 76.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.644 -0.707 . . . . 2.41 111.681 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 31' ' ' THR . 40.4 mm-40 -69.86 -33.2 71.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 1.96 111.407 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 67.6 t -75.59 -51.27 21.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.035 0.445 . . . . 0.98 110.8 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.427 ' HB3' ' CG2' ' A' ' 101' ' ' THR . 14.6 m-85 -48.14 -50.61 28.12 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 113.791 1.034 . . . . 0.83 113.791 174.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.8 mtmt -73.73 -25.55 60.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.115 -0.634 . . . . 2.18 111.571 -175.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.56 -79.16 0.06 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.17 -0.308 . . . . 1.56 110.17 174.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.538 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.43 -148.23 3.41 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.749 -0.739 . . . . 1.54 112.395 -173.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.458 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.5 149.82 12.9 Favored 'Cis proline' 0 N--CA 1.454 -0.813 0 CA-C-N 118.734 1.267 . . . . 1.68 111.116 -8.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.538 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 18.0 m-85 -118.44 128.12 54.31 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.485 0.659 . . . . 1.28 111.62 -170.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -86.89 -15.15 39.87 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.67 -1.15 . . . . 3.51 108.314 175.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.401 ' ND2' ' HG3' ' A' ' 47' ' ' GLU . 7.3 p30 -150.71 150.52 31.16 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.079 -1.082 . . . . 1.52 108.079 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.562 HG21 ' NE2' ' A' ' 67' ' ' HIS . 4.7 m -77.04 -16.12 59.38 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.87 -0.332 . . . . 1.18 111.694 -171.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -62.45 -26.88 68.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.811 0.339 . . . . 2.24 110.21 174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.7 mt-10 -65.09 -41.37 95.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 2.26 110.583 173.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 41.2 t -69.17 -41.46 77.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.143 0.496 . . . . 1.19 110.046 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 98.0 mt -61.01 -44.33 97.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.674 -0.694 . . . . 0.55 110.057 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -51.42 69.54 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 0.57 111.661 174.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 55' ' ' LYS . . . -56.93 -43.16 81.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.286 0.565 . . . . 0.5 110.718 -179.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.56 HD21 HD13 ' A' ' 33' ' ' LEU . 45.9 mt -68.36 -34.03 75.34 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.298 -0.864 . . . . 0.45 111.241 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -67.09 -28.52 68.25 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.739 0.304 . . . . 1.22 111.222 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -76.52 -45.13 32.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.035 0.445 . . . . 3.05 110.739 176.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 51' ' ' ALA . 31.1 mmmt -67.27 -46.77 72.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.865 -0.607 . . . . 1.48 111.149 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.447 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 22.9 t -149.5 102.18 3.29 Favored Pre-proline 0 C--N 1.315 -0.919 0 C-N-CA 120.818 -0.353 . . . . 1.16 110.327 -177.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 4.4 Cg_endo -47.09 -59.62 1.18 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 123.581 2.854 . . . . 0.58 113.346 -168.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -69.16 -28.04 66.08 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.578 -0.737 . . . . 2.45 111.283 -177.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -40.36 81.47 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.241 -1.022 . . . . 1.42 108.241 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.81 -23.08 65.08 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 114.365 -1.289 . . . . 0.37 112.156 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.72 -31.1 66.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.867 0.365 . . . . 0.48 110.733 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -65.63 -47.23 76.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.289 -0.414 . . . . 2.17 110.539 178.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.39 -29.0 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.036 0.446 . . . . 1.12 110.736 179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 4.9 tm-20 -60.79 -55.17 36.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.692 -0.686 . . . . 1.7 110.239 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.5 ptmm? -62.52 -30.28 71.17 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-O 121.148 0.499 . . . . 3.96 109.911 -176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.518 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.49 -1.45 15.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.514 -0.766 . . . . 1.5 111.274 -176.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.632 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 67.5 m80 -118.88 -46.79 2.53 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.241 -0.436 . . . . 2.34 110.821 175.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.42 -43.41 83.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 111.612 0.227 . . . . 0.4 111.612 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 33.8 mtm -61.2 -41.34 96.66 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.474 0.654 . . . . 0.72 110.237 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 96.0 t -71.39 -40.41 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.77 0 CA-C-N 115.211 -0.904 . . . . 0.79 110.76 -178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 30.4 mmmt -60.55 -34.93 74.86 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.735 -0.666 . . . . 1.47 111.018 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.3 m -60.2 -33.0 71.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.289 0.566 . . . . 1.26 111.135 177.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.432 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.2 mttp -82.24 -42.59 18.7 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.562 -0.744 . . . . 1.54 110.194 178.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -69.6 -24.07 26.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.213 0.53 . . . . 0.34 111.055 178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.0 -26.82 64.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.945 0.879 . . . . 0.35 109.558 174.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -94.34 2.5 55.82 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.32 -1.309 . . . . 0.49 110.101 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.496 HD11 ' HA ' ' A' ' 132' ' ' PHE . 12.1 tp -96.44 136.35 37.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.533 -0.758 . . . . 0.71 109.958 -175.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.5 153.05 51.3 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.592 -0.813 . . . . 0.76 112.32 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -42.53 -41.31 7.91 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 124.558 3.505 . . . . 1.56 113.518 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -64.01 -49.52 72.12 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.948 -0.569 . . . . 2.52 110.787 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.535 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.05 -31.91 34.28 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.904 -0.589 . . . . 0.36 110.664 -176.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -56.02 -48.03 76.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.503 -0.771 . . . . 2.04 110.881 175.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.04 -40.0 94.99 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.819 -0.705 . . . . 0.41 111.917 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.456 ' CE2' ' HB2' ' A' ' 121' ' ' TYR . 4.9 t80 -69.37 -44.23 71.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.74 -0.23 . . . . 1.65 111.08 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.38 -49.72 76.24 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.089 0.471 . . . . 0.41 111.047 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -67.32 -14.23 62.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.611 -0.722 . . . . 1.96 111.058 -178.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.4 tptp -94.53 -46.5 6.95 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.476 -0.329 . . . . 2.12 110.691 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.4 p -65.25 -34.22 77.83 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.321 -0.4 . . . . 0.57 110.728 -178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.441 HG23 ' NH1' ' A' ' 93' ' ' ARG . 17.7 mt -55.77 -46.05 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 115.979 -0.555 . . . . 1.09 110.745 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -70.06 -32.21 70.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.775 0.322 . . . . 2.82 110.989 -177.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.8 mt -67.63 -51.81 47.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.114 0.483 . . . . 0.51 110.351 176.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.12 68.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.64 110.934 -178.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.487 ' NH2' HD12 ' A' ' 66' ' ' LEU . 4.4 mpt_? -69.7 -32.79 71.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.938 -0.574 . . . . 4.42 110.28 173.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -65.61 -38.73 94.94 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.155 -0.545 . . . . 0.66 112.081 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.425 HD11 ' CB ' ' A' ' 113' ' ' SER . 38.9 mm -56.64 -51.04 71.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 121.26 0.552 . . . . 0.55 110.129 178.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 3.2 mppt? -93.8 28.64 2.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.807 -0.633 . . . . 2.7 110.181 179.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -108.1 -33.66 7.1 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.457 -0.942 . . . . 0.63 108.457 164.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.521 ' HB2' ' OD1' ' A' ' 103' ' ' ASN . 5.2 ptp180 -86.17 -9.65 56.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.543 -0.753 . . . . 3.1 109.995 175.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 12.9 m-85 -77.38 -29.97 53.46 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.112 -0.699 . . . . 0.97 109.112 163.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' ' HG ' ' A' ' 25' ' ' LEU . 2.5 m-85 -83.94 -52.77 6.07 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.515 -0.766 . . . . 1.48 111.994 -177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.504 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 10.5 p -59.12 -26.3 64.59 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.299 0.852 . . . . 0.87 113.299 -173.012 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 108.89 39.31 1.73 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.699 -0.762 . . . . 1.16 113.608 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.521 ' OD1' ' HB2' ' A' ' 98' ' ' ARG . 4.5 p30 -149.08 68.8 1.05 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.33 0.586 . . . . 1.83 109.995 173.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -45.12 125.89 5.53 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 114.834 -1.075 . . . . 1.75 111.944 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.48 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 58.1 Cg_endo -74.19 155.35 46.95 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 122.989 2.459 . . . . 0.53 111.937 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 171.63 8.96 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.145 -0.687 . . . . 1.48 109.145 173.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -62.01 -29.8 70.51 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.388 -0.525 . . . . 2.88 110.646 -176.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -66.36 -31.31 72.02 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.879 -0.6 . . . . 2.24 110.863 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -67.99 -46.81 70.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.375 -0.375 . . . . 1.73 110.292 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.597 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.0 mp -63.81 -43.1 97.27 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.024 -0.535 . . . . 0.82 110.031 176.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 151' ' ' PHE . 41.8 tttp -52.6 -53.29 48.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.651 -0.704 . . . . 1.74 110.528 178.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.461 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -62.65 -39.25 93.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.284 -0.871 . . . . 0.47 111.592 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.425 ' CB ' HD11 ' A' ' 95' ' ' ILE . 49.4 m -67.48 -44.5 78.39 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.841 0.682 . . . . 1.34 112.841 -178.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.597 HG13 ' O ' ' A' ' 110' ' ' LEU . 2.9 m -71.27 -28.38 32.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.159 0 N-CA-C 108.607 -0.886 . . . . 0.65 108.607 -179.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 84.4 tttt -53.62 -39.17 64.71 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.295 . . . . 1.72 111.25 178.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.566 ' O ' HD13 ' A' ' 120' ' ' LEU . 25.3 mt-10 -73.72 -36.82 65.24 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 120.113 -0.635 . . . . 2.27 111.322 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 114' ' ' VAL . 1.8 m -64.77 -31.92 55.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 C-N-CA 119.98 -0.688 . . . . 0.81 110.459 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.47 HD23 ' HE2' ' A' ' 122' ' ' LYS . 6.8 mp -80.05 -31.76 39.45 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.768 -0.583 . . . . 1.21 110.483 172.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -55.12 -42.7 73.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.852 0.834 . . . . 0.95 109.369 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.566 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -77.37 -47.02 20.97 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.45 -1.25 . . . . 1.06 112.11 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.456 ' HB2' ' CE2' ' A' ' 84' ' ' PHE . 20.6 t80 -70.33 -33.75 71.85 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 119.61 -0.836 . . . . 1.54 111.775 -170.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.47 ' HE2' HD23 ' A' ' 118' ' ' LEU . 68.1 mttm -66.82 -30.6 70.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.02 0.438 . . . . 1.98 111.174 179.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -84.84 -7.27 59.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.756 -0.656 . . . . 0.7 112.604 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.535 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 58.7 mtm -74.53 158.44 33.77 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.506 -0.478 . . . . 0.5 110.951 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 7.3 m -65.07 145.72 55.94 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.45 -0.341 . . . . 1.18 110.282 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -53.75 -47.25 70.84 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.01 0.374 . . . . 2.21 112.01 -173.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.86 -27.46 69.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.925 0.393 . . . . 0.42 110.992 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.48 -34.22 29.29 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.743 -0.543 . . . . 0.31 111.743 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -66.78 -45.04 79.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 1.32 109.98 177.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.418 ' O ' ' HG3' ' A' ' 134' ' ' LYS . . . -68.7 -26.44 65.29 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.367 -0.833 . . . . 0.42 110.691 178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.458 ' OD2' HD12 ' A' ' 77' ' ' LEU . 24.6 t70 -78.28 -29.28 47.87 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.209 -0.663 . . . . 0.55 109.209 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.496 ' HA ' HD11 ' A' ' 77' ' ' LEU . 84.2 t80 -66.4 -34.05 77.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 0.39 110.189 173.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.31 -13.96 65.79 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.933 -0.651 . . . . 0.27 112.704 179.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 130' ' ' ALA . 58.2 mttm -91.17 -16.69 27.32 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.224 0.535 . . . . 2.43 110.529 -178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.432 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 57.2 mm-40 -110.87 -35.92 5.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.617 -0.72 . . . . 1.83 110.27 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -122.68 76.41 47.01 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 109.589 -0.523 . . . . 0.69 109.589 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.14 -30.32 46.86 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.828 2.352 . . . . 0.63 113.074 -172.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.604 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 11.9 m-85 -77.76 -36.06 51.07 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.186 0.439 . . . . 2.31 112.186 -176.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.3 mt -71.81 -47.53 52.67 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 119.904 -0.718 . . . . 1.02 109.716 177.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.71 -35.42 72.63 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.054 0.454 . . . . 0.35 110.051 177.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 84.1 tttt -50.25 -73.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.272 -0.876 . . . . 2.58 111.19 171.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.545 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.7 m -65.39 -25.54 37.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-N 115.336 -0.847 . . . . 0.5 112.667 -172.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 20.0 m-30 -69.5 -50.79 41.89 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.557 -0.457 . . . . 0.62 110.606 -179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.7 -28.75 64.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 2.58 111.425 -176.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.1 m -76.56 -9.45 58.67 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.02 0.438 . . . . 1.32 110.729 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 78.56 17.65 77.21 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 121.128 -0.558 . . . . 1.09 112.621 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.479 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 0.8 OUTLIER -74.27 -51.73 14.43 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.407 -0.59 . . . . 1.98 109.407 -178.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -65.6 -33.85 76.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.132 0.492 . . . . 0.34 110.166 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -60.58 -35.6 76.47 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.51 110.781 176.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -73.23 -34.65 66.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.046 0.45 . . . . 2.82 110.483 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.485 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 38.1 t80 -63.56 -45.11 92.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.97 -0.559 . . . . 0.49 109.705 175.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -75.07 -22.24 58.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.858 -0.61 . . . . 0.59 111.519 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 116.88 -73.45 0.28 Allowed Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 110.282 -1.127 . . . . 1.62 110.282 -175.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -176.79 67.2 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.136 -1.061 . . . . 4.12 108.136 169.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.451 ' O ' ' HE3' ' A' ' 115' ' ' LYS . 58.6 t30 . . . . . 0 C--O 1.246 0.884 0 CA-C-N 114.016 -1.447 . . . . 4.01 111.494 -171.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 110.019 -0.363 . . . . 23.59 110.019 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 76.06 -98.38 1.21 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.743 -0.741 . . . . 22.47 111.997 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 9.3 t -89.17 56.59 3.72 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.261 0.553 . . . . 21.51 109.788 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 15.5 m -122.61 47.78 1.88 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 20.19 110.369 -179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 72.0 m80 -79.4 93.77 5.41 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.926 -0.579 . . . . 21.42 109.517 178.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -70.1 105.38 2.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.967 -0.56 . . . . 18.2 112.054 -173.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 61.8 m80 -81.87 86.99 6.41 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.855 -0.795 . . . . 16.06 108.855 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -68.59 140.38 55.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.725 -0.671 . . . . 13.27 111.712 -171.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 15.9 m-70 68.26 166.15 0.25 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.473 -0.785 . . . . 12.33 112.203 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -75.2 90.08 2.55 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.505 -0.77 . . . . 11.33 110.057 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 47.0 t 63.83 70.13 0.52 Allowed 'General case' 0 C--N 1.33 -0.266 0 O-C-N 123.733 0.646 . . . . 7.95 110.743 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 38.0 t -73.53 -33.72 64.87 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.957 -0.757 . . . . 7.36 108.957 174.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -124.13 -92.21 0.98 Allowed Glycine 0 N--CA 1.44 -1.039 0 CA-C-N 115.114 -0.948 . . . . 4.57 111.127 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 6.1 t60 57.71 42.78 23.16 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.386 0.612 . . . . 4.52 109.68 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 11.0 tpt -138.82 110.82 7.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.761 -0.654 . . . . 2.0 110.186 -178.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.706 ' CD1' ' HB3' ' A' ' 99' ' ' TYR . 67.8 t80 -68.59 131.34 45.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.944 -0.571 . . . . 1.47 110.908 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 3' ' ' TYR . 28.8 mtmm -120.86 -83.15 0.66 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.283 -0.417 . . . . 3.15 111.018 174.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.429 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 47.4 t80 167.25 -42.74 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.669 -0.863 . . . . 2.35 108.669 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.459 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 52.7 mt-10 -66.49 -18.88 65.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.932 -1.031 . . . . 4.16 110.685 175.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -89.75 -5.34 57.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.053 -0.522 . . . . 2.57 111.193 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 1' ' ' PHE . 44.7 mt -80.84 137.16 50.53 Favored Pre-proline 0 C--N 1.327 -0.371 0 N-CA-C 108.702 -0.851 . . . . 0.69 108.702 174.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -46.9 115.39 1.26 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.709 2.272 . . . . 0.6 111.716 176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.86 -20.55 65.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.043 -0.526 . . . . 0.57 111.209 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.03 -35.92 82.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.648 0.737 . . . . 1.37 110.097 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -83.66 -29.16 27.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.688 -1.142 . . . . 0.8 111.414 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 20.9 mtm180 -69.23 -20.85 63.96 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.508 0.671 . . . . 1.73 109.427 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -68.16 -15.14 63.46 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.597 -1.183 . . . . 1.02 110.473 175.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.3 mt -104.27 -0.46 28.29 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.93 110.827 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.5 mtt -81.67 130.32 61.82 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.605 -0.271 . . . . 1.15 111.281 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_exo -56.43 138.59 84.65 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.731 2.287 . . . . 0.9 111.505 175.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.417 ' HD3' ' CG ' ' A' ' 138' ' ' PHE . 18.7 Cg_endo -59.26 -29.37 90.15 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 123.53 2.82 . . . . 0.96 112.79 -173.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -70.48 -49.08 52.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.233 -0.44 . . . . 1.83 110.083 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.9 71.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.052 -0.522 . . . . 0.82 110.956 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -67.87 -40.64 83.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.875 -0.602 . . . . 2.16 111.022 177.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -52.88 -46.03 67.76 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.397 0.436 . . . . 1.06 111.278 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.635 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 30.9 t80 -57.74 -61.0 2.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.075 -0.511 . . . . 0.65 111.265 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 25' ' ' LEU . 8.2 mp -72.69 -8.25 54.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.994 0.816 . . . . 1.13 112.261 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -70.68 -57.35 4.78 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 120.852 0.358 . . . . 2.06 110.986 163.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -80.22 -37.07 33.84 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.036 -0.529 . . . . 1.84 111.905 -171.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.72 ' CD1' ' HB2' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -63.89 137.19 57.92 Favored 'General case' 0 N--CA 1.434 -1.267 0 N-CA-C 109.653 -0.499 . . . . 1.05 109.653 179.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.7 p -123.95 179.37 4.87 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.456 -0.338 . . . . 1.78 111.77 -170.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -56.45 -41.06 75.86 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.845 0.683 . . . . 2.39 112.845 -171.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.16 -34.06 82.49 Favored Glycine 0 CA--C 1.518 0.251 0 C-N-CA 120.727 -0.749 . . . . 0.93 112.481 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.72 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 0.8 OUTLIER -85.0 -33.82 22.47 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.979 0.419 . . . . 2.25 109.887 178.938 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HG3' HD11 ' A' ' 25' ' ' LEU . 87.0 mttt -66.98 -10.8 53.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.557 0.694 . . . . 1.31 109.99 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 90.6 m -74.2 -31.94 62.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.871 -1.059 . . . . 0.8 110.486 174.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.642 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 10.2 p -87.14 -28.82 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 C-N-CA 120.671 -0.411 . . . . 0.85 110.913 179.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.402 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.3 mm? -52.19 -48.7 64.89 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.348 0.118 . . . . 0.98 111.182 174.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -63.84 -34.18 77.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.767 0.318 . . . . 2.41 111.438 -178.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -68.9 -39.61 79.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.375 -0.375 . . . . 1.96 110.84 -179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.98 -43.81 38.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-O 121.177 0.513 . . . . 0.98 111.103 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.402 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 20.0 m-85 -60.2 -33.74 72.66 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 113.661 0.986 . . . . 0.83 113.661 174.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -92.52 9.39 34.71 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 119.656 -0.818 . . . . 2.18 110.547 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -101.97 -78.9 0.53 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.334 -0.848 . . . . 1.56 108.887 172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.532 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 48.59 -151.35 3.03 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.85 -0.691 . . . . 1.54 112.808 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 18.5 Cg_endo -93.29 130.92 5.83 Favored 'Cis proline' 0 N--CA 1.453 -0.9 0 C-N-CA 124.163 -1.182 . . . . 1.68 110.916 -9.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.532 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 19.5 m-85 -105.55 120.29 41.27 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.438 -0.801 . . . . 1.28 111.31 -170.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.4 tttp -73.14 -16.86 61.44 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.089 -0.96 . . . . 3.51 110.212 176.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.425 HD21 ' HG3' ' A' ' 47' ' ' GLU . 6.9 p30 -144.39 174.54 10.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.233 -0.439 . . . . 1.52 110.17 -175.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 41.7 m -75.89 -37.05 59.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.906 0.384 . . . . 1.18 111.165 -177.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -60.16 -35.24 74.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.023 -0.535 . . . . 2.24 112.321 -175.137 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 38.8 mt-10 -61.28 -36.63 80.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.895 0.378 . . . . 2.26 110.985 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 30.0 t -74.34 -34.91 63.55 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.853 -0.425 . . . . 1.19 109.853 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.6 mt -62.92 -42.26 95.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.561 0.696 . . . . 0.55 109.6 176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.23 -49.85 76.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.667 -1.151 . . . . 0.57 111.802 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.05 79.89 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.087 -0.506 . . . . 0.5 110.896 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 33.4 mt -67.99 -40.32 83.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 0.45 110.855 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -62.38 -34.71 77.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.692 0.282 . . . . 1.22 111.657 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -66.23 -44.48 83.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.24 -0.437 . . . . 3.05 110.84 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.642 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 8.5 tppt? -77.11 -56.32 4.67 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.937 0.398 . . . . 1.48 110.543 177.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.419 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 52.3 m -125.34 103.99 28.9 Favored Pre-proline 0 C--N 1.316 -0.869 0 CA-C-O 121.51 0.671 . . . . 1.16 109.992 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 19.7 Cg_endo -58.63 -56.21 1.63 Allowed 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 123.635 2.89 . . . . 0.58 113.361 -170.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 48.6 mm-40 -73.88 -24.27 59.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.802 -0.636 . . . . 2.45 111.084 -178.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.552 ' HG ' ' HB3' ' A' ' 29' ' ' ASP . 0.9 OUTLIER -71.05 -42.92 68.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.813 -0.81 . . . . 1.42 108.813 -178.078 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.62 -24.36 76.95 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.392 -1.276 . . . . 0.37 111.619 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.99 -36.02 74.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.809 0.337 . . . . 0.48 110.82 175.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 66.9 mttm -60.56 -54.7 42.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.956 -0.565 . . . . 2.17 110.72 178.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.8 p -65.78 -30.21 49.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 1.12 110.958 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -61.36 -60.37 3.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.279 -0.419 . . . . 1.7 111.164 177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.527 ' O ' ' HG3' ' A' ' 69' ' ' MET . 91.5 mttt -62.52 -33.2 74.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 3.96 110.345 -176.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.61 HD22 ' HB2' ' A' ' 21' ' ' PHE . 34.2 tp -64.9 -41.3 95.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.352 -0.84 . . . . 1.5 110.602 176.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -72.66 -32.09 65.59 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.955 -0.757 . . . . 2.34 108.955 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.53 -36.02 76.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.409 -1.269 . . . . 0.4 111.526 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 44.2 mtm -65.59 -51.28 60.93 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 121.262 0.553 . . . . 0.72 110.137 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.7 t -60.47 -39.68 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 115.312 -0.858 . . . . 0.79 110.094 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.9 tpmt? -60.06 -40.39 89.3 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 115.615 -0.721 . . . . 1.47 110.439 176.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 21.9 t -61.64 -38.13 86.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.05 0.452 . . . . 1.26 110.685 -179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -75.55 -47.19 27.92 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.052 -0.522 . . . . 1.54 110.341 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 73.2 mt -63.2 -20.96 27.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.586 0.708 . . . . 0.34 110.388 177.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.29 -30.73 63.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.2 -0.909 . . . . 0.35 110.005 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.1 -3.2 58.06 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.44 -1.254 . . . . 0.49 110.008 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.3 tp -91.95 130.54 37.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.241 -0.89 . . . . 0.71 109.596 -178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.91 155.25 50.65 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.84 -0.695 . . . . 0.76 111.741 -178.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -44.37 -40.19 12.96 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 123.659 2.906 . . . . 1.56 114.073 -176.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -62.46 -41.21 98.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.846 0.355 . . . . 2.52 111.012 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.416 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -92.93 -32.42 14.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.144 0.497 . . . . 0.36 111.038 -177.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.406 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.0 ttpt -60.31 -39.5 87.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.615 -0.721 . . . . 2.04 111.305 178.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.05 -44.02 98.35 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.473 -0.87 . . . . 0.41 111.727 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -67.67 -45.57 74.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.247 . . . . 1.65 111.422 178.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.763 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -52.32 -60.21 3.49 Favored 'General case' 0 C--O 1.223 -0.325 0 O-C-N 123.239 0.337 . . . . 0.41 111.469 -176.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.628 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 32.3 mt-10 -62.4 -36.14 81.4 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.823 -0.351 . . . . 1.96 110.973 -174.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -70.5 -41.84 72.13 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.278 -0.419 . . . . 2.12 110.974 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.3 p -69.68 -32.48 71.12 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.936 -0.306 . . . . 0.57 110.515 177.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.763 HG12 ' O ' ' A' ' 85' ' ' ALA . 46.2 mm -59.51 -39.06 78.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 109.787 -0.449 . . . . 1.09 109.787 173.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.628 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 52.3 mt-10 -60.48 -43.07 97.35 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.343 -0.389 . . . . 2.82 110.47 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.2 mt -65.63 -46.06 90.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.51 111.05 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.27 -31.59 71.16 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.225 0.535 . . . . 0.64 110.421 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.488 ' NH2' ' HG2' ' A' ' 90' ' ' GLU . 43.2 mtm180 -69.84 -35.98 75.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.871 -0.604 . . . . 4.42 110.457 174.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.04 -42.3 98.22 Favored Glycine 0 N--CA 1.451 -0.325 0 O-C-N 123.325 0.391 . . . . 0.66 113.005 -176.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.9 mm -59.01 -49.07 84.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.202 0.525 . . . . 0.55 110.533 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.469 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 20.6 pttp -81.29 -7.71 59.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.866 -0.606 . . . . 2.7 111.232 179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -77.34 -39.88 46.05 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.3 0.571 . . . . 0.63 109.983 174.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -86.92 10.03 17.51 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.613 -0.721 . . . . 3.1 109.645 176.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.706 ' HB3' ' CD1' ' A' ' 1' ' ' PHE . 5.4 m-85 -98.43 -40.23 8.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.574 -0.739 . . . . 0.97 110.017 162.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -55.35 -38.99 69.49 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.168 0.509 . . . . 1.48 111.251 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.7 p -70.66 -1.97 12.95 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.272 -0.876 . . . . 0.87 112.817 -173.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.7 2.31 75.92 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.626 -0.797 . . . . 1.16 111.345 -175.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -90.53 169.93 10.62 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.035 -0.728 . . . . 1.83 109.035 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.1 mt-10 -142.59 106.09 5.46 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.582 0.23 . . . . 1.75 110.751 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.567 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 23.0 Cg_endo -64.74 141.09 70.62 Favored 'Trans proline' 0 C--O 1.237 0.445 0 C-N-CA 122.434 2.09 . . . . 0.53 111.304 174.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.4 t -72.56 161.26 31.02 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.055 -0.72 . . . . 1.48 109.055 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.2 -19.63 63.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.818 0.342 . . . . 2.88 111.145 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.21 -40.92 86.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.254 -0.43 . . . . 2.24 110.185 176.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -58.27 -41.48 84.42 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.43 0.633 . . . . 1.73 110.243 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.53 ' O ' HG23 ' A' ' 114' ' ' VAL . 11.0 mp -64.49 -50.75 66.21 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 114.92 -1.036 . . . . 0.82 110.42 178.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -53.51 -52.82 58.38 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.404 -0.362 . . . . 1.74 110.951 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.72 86.58 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.912 -0.585 . . . . 0.47 111.321 -178.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.56 ' O ' HG23 ' A' ' 117' ' ' VAL . 68.6 m -66.74 -39.02 87.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.284 -0.416 . . . . 1.34 111.586 -179.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 110' ' ' LEU . 48.8 t -77.93 -37.54 23.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.551 0.691 . . . . 0.65 109.377 -177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 154' ' ' GLU . 22.2 ttmm -54.24 -39.83 67.15 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.792 -1.095 . . . . 1.72 110.727 173.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.52 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.6 tt0 -74.28 -32.4 62.89 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 116.569 -0.287 . . . . 2.27 110.385 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 113' ' ' SER . 99.3 t -59.21 -45.22 93.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.255 0.55 . . . . 0.81 110.358 172.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 29.8 mt -69.25 -28.0 65.94 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.614 -0.721 . . . . 1.21 110.096 178.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.508 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 33.3 ttpt -61.21 -42.23 98.23 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.822 -0.807 . . . . 0.95 108.822 177.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.3 mp -71.87 -51.69 21.07 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.188 -0.915 . . . . 1.06 111.374 174.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.616 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 0.0 OUTLIER -69.89 -36.92 75.82 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 119.223 -0.991 . . . . 1.54 111.862 -167.243 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -64.6 -30.27 71.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.826 0.346 . . . . 1.98 111.146 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.15 -4.85 59.26 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.506 0.558 . . . . 0.7 112.506 -176.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.502 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 55.8 mtm -75.45 161.34 29.3 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.5 -0.48 . . . . 0.5 111.771 -177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 5.8 m -59.67 144.15 48.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.784 -0.644 . . . . 1.18 109.785 170.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.98 -40.79 94.79 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.555 0.217 . . . . 2.21 111.378 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.34 -29.6 70.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.917 0.389 . . . . 0.42 110.636 177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -71.28 -37.56 63.17 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 111.446 -0.662 . . . . 0.31 111.446 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.616 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 97.1 mttt -65.76 -46.89 77.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.261 0.553 . . . . 1.32 109.902 178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.36 -35.56 81.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.414 -0.812 . . . . 0.42 111.472 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -76.04 -33.59 59.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.002 0.429 . . . . 0.55 110.006 -176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -59.39 -27.47 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.705 -0.679 . . . . 0.39 110.146 172.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.523 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.56 -6.31 70.69 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 116.013 -0.54 . . . . 0.27 113.451 -179.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -95.53 -50.55 4.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.226 0.536 . . . . 2.43 110.143 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.409 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -81.01 -20.92 40.74 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.2 -0.909 . . . . 1.83 111.168 -178.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -137.3 69.99 54.84 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.764 0.316 . . . . 0.69 111.102 174.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.17 -42.17 59.71 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 123.173 2.582 . . . . 0.63 113.067 -178.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.511 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 30.7 t80 -61.87 -46.73 88.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.404 -0.362 . . . . 2.31 111.37 -176.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 80.7 mt -72.45 -43.09 64.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.023 -0.271 . . . . 1.02 110.911 -177.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.523 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.86 -39.42 77.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.762 0.315 . . . . 0.35 110.225 177.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.511 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 38.9 ttpt -47.27 -66.49 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.371 -0.831 . . . . 2.58 111.115 173.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.4 ' HA ' ' HB3' ' A' ' 147' ' ' LYS . 3.3 m -64.78 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 115.515 -0.766 . . . . 0.5 112.824 -174.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.511 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 21.6 m-85 -76.14 -48.99 18.52 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.847 -0.741 . . . . 0.62 110.68 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -66.24 -38.7 88.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.4 -0.363 . . . . 2.58 111.151 -177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 13.5 m -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.452 . . . . 1.32 111.806 -176.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.478 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 83.62 12.46 77.84 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.692 -0.766 . . . . 1.09 112.574 178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.4 ' HB3' ' HA ' ' A' ' 142' ' ' VAL . 9.7 tppt? -61.5 -53.85 50.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.995 0.426 . . . . 1.98 110.647 178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.53 -29.15 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.776 -0.647 . . . . 0.34 110.657 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.66 85.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.841 -0.618 . . . . 0.51 111.071 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 41.9 mmtm -69.95 -21.07 63.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.086 0.469 . . . . 2.82 110.629 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -91.71 -39.71 11.67 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.758 -0.656 . . . . 0.49 110.616 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.412 ' HB2' ' HB ' ' A' ' 114' ' ' VAL . . . -85.94 -4.07 59.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.731 -0.668 . . . . 0.59 112.278 -177.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 70.13 27.43 72.94 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 110.926 -0.87 . . . . 1.62 110.926 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 115' ' ' LYS . 30.4 tt0 66.39 170.88 0.24 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.765 0.826 . . . . 4.12 110.832 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 30.2 t30 . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.512 -0.756 . . . . 4.01 109.611 176.198 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . 0.506 ' SD ' ' HB3' ' A' ' 26' ' ' SER . 94.6 mmm . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 110.289 -0.263 . . . . 23.59 110.289 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 87.03 44.93 5.54 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.859 -0.686 . . . . 22.47 111.751 -178.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 10.0 m -80.12 78.23 6.79 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 122.135 0.174 . . . . 21.51 110.908 -178.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 43.8 t 68.9 -60.99 0.43 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.536 0.735 . . . . 20.19 111.742 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 26.4 m170 -102.83 110.02 21.79 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.685 -0.487 . . . . 21.42 109.685 -177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -114.67 74.8 0.89 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.776 0.798 . . . . 18.2 110.717 -179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -134.45 -158.51 0.89 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.059 -0.973 . . . . 16.06 108.735 178.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -76.45 -38.22 55.77 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.014 -0.735 . . . . 13.27 109.014 173.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 55.9 27.17 10.67 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 114.829 -1.078 . . . . 12.33 112.405 166.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 57.84 77.61 0.27 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.132 -0.485 . . . . 11.33 110.868 -176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.9 m -57.21 135.82 56.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.169 -0.469 . . . . 7.95 110.256 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 18.8 m -90.49 35.26 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.368 -0.378 . . . . 7.36 111.427 -175.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 75.7 -78.01 1.22 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.129 -0.558 . . . . 4.57 112.302 178.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -129.39 134.77 48.03 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.852 -0.425 . . . . 4.52 109.852 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.464 ' HG3' ' OD1' ' A' ' 27' ' ' ASP . 95.8 mmm -130.88 143.69 50.92 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.682 -0.488 . . . . 2.0 109.682 179.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.4 p90 -75.71 149.73 38.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.985 0.421 . . . . 1.47 110.467 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 tttm -123.77 153.39 41.01 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.534 -0.543 . . . . 3.15 109.534 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -54.45 -45.32 73.07 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.281 0.562 . . . . 2.35 109.576 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -61.93 -27.7 69.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.148 -0.933 . . . . 4.16 112.064 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -79.44 -23.21 43.3 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.091 0.472 . . . . 2.57 110.329 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 72.8 mt -71.44 133.71 84.93 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 109.184 -0.673 . . . . 0.69 109.184 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -44.25 110.46 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.14 2.56 . . . . 0.6 112.249 177.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.78 -21.84 66.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.493 -0.776 . . . . 0.57 112.209 -171.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.42 -35.42 80.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.332 0.587 . . . . 1.37 110.316 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 14' ' ' MET . 37.5 t80 -84.42 -29.4 26.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.09 -0.959 . . . . 0.8 110.956 -178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.62 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 11.9 mtm180 -65.95 -27.15 67.95 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.703 0.764 . . . . 1.73 109.059 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.41 -24.67 66.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.469 -1.241 . . . . 1.02 110.24 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.547 HD21 ' HG3' ' A' ' 147' ' ' LYS . 9.9 mt -97.55 1.78 49.33 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.639 -0.709 . . . . 0.93 110.191 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 96.0 mtp -96.47 137.37 21.54 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.153 -0.476 . . . . 1.15 110.071 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.06 142.03 95.94 Favored 'Trans proline' 0 C--O 1.235 0.333 0 C-N-CA 122.626 2.217 . . . . 0.9 111.678 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -59.69 -19.07 51.58 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.464 2.776 . . . . 0.96 112.472 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.43 ' O ' HD11 ' A' ' 66' ' ' LEU . 4.0 mm-40 -62.57 -55.25 29.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.598 -0.728 . . . . 1.83 109.616 176.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.87 -28.6 65.78 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.482 -0.781 . . . . 0.82 111.01 -178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 35.5 mtp180 -67.12 -48.4 68.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.952 -0.567 . . . . 2.16 110.802 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 24.8 t70 -53.7 -46.82 70.86 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.515 0.198 . . . . 1.06 111.028 176.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.666 ' O ' HD23 ' A' ' 25' ' ' LEU . 40.3 t80 -53.44 -60.3 3.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.985 -0.552 . . . . 0.65 111.049 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.538 HD21 ' CE1' ' A' ' 100' ' ' TYR . 83.8 mt -74.75 -4.66 38.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 119.31 0.959 . . . . 1.13 112.388 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 37.8 mt-30 -71.92 -46.26 58.25 Favored 'General case' 0 C--N 1.319 -0.736 0 O-C-N 122.314 -0.241 . . . . 2.06 111.405 162.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.517 HD21 ' HA ' ' A' ' 21' ' ' PHE . 11.1 p30 -83.37 -26.88 30.09 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.525 0.565 . . . . 1.84 112.525 -175.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.666 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -63.13 134.9 56.77 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.841 -0.429 . . . . 1.05 109.841 166.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.506 ' HB3' ' SD ' ' A' ' -14' ' ' MET . 49.8 m -159.23 55.27 0.4 Allowed 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.236 0.458 . . . . 1.78 112.236 -174.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.464 ' OD1' ' HG3' ' A' ' 0' ' ' MET . 20.0 t70 71.98 143.06 0.06 Allowed 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.325 0.584 . . . . 2.39 111.238 176.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.02 -49.14 4.07 Favored Glycine 0 N--CA 1.451 -0.32 0 N-CA-C 110.776 -0.93 . . . . 0.93 110.776 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 4.7 p30 -78.72 -49.43 13.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.112 -0.544 . . . . 2.25 110.28 173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.434 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 89.2 mttt -55.32 -26.45 40.73 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.377 0.608 . . . . 1.31 110.703 174.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.477 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 14.9 m -64.69 -32.87 74.73 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.212 -0.903 . . . . 0.8 111.102 -178.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.8 p -90.62 -23.61 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 CA-C-N 116.23 -0.441 . . . . 0.85 110.512 -178.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.59 -49.03 71.39 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 116.49 -0.323 . . . . 0.98 110.895 171.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 20.9 ptmt -65.43 -27.67 68.69 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.424 -0.353 . . . . 2.41 111.407 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -67.26 -37.33 83.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 1.96 110.157 177.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 51' ' ' ALA . 61.4 t -73.54 -53.97 16.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.252 0.549 . . . . 0.98 110.468 177.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.485 ' HE1' HD12 ' A' ' 33' ' ' LEU . 27.5 m-85 -53.93 -45.11 71.14 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 114.345 1.239 . . . . 0.83 114.345 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -79.08 -1.4 35.64 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 119.988 -0.685 . . . . 2.18 111.16 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -99.82 17.08 21.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.394 0.616 . . . . 1.56 109.668 172.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -88.06 -160.61 36.01 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.444 -0.798 . . . . 1.54 111.62 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.78 160.8 95.45 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 123.334 -1.527 . . . . 1.68 112.256 -1.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -112.52 127.29 56.02 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.136 0.493 . . . . 1.28 110.252 177.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -65.65 -21.98 66.6 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.862 -1.063 . . . . 3.51 110.996 -178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.77 141.48 20.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.735 -0.666 . . . . 1.52 110.093 -176.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 80.4 m -57.72 -28.31 63.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.242 -0.89 . . . . 1.18 112.215 -175.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.64 -34.93 69.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.256 -0.429 . . . . 2.24 111.695 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -73.24 -34.22 65.75 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.689 0.255 . . . . 2.26 111.689 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m -64.57 -41.02 96.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.309 0.576 . . . . 1.19 109.821 176.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.9 mt -67.19 -43.14 88.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.392 -0.822 . . . . 0.55 110.561 178.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -58.11 -47.25 83.85 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.364 -0.835 . . . . 0.57 110.824 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.488 ' HB3' HG13 ' A' ' 36' ' ' VAL . . . -59.38 -37.46 77.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.084 -0.507 . . . . 0.5 110.481 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.518 HD21 HD13 ' A' ' 33' ' ' LEU . 21.3 mt -69.74 -40.32 76.26 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.529 -0.759 . . . . 0.45 110.891 176.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.3 mttm -66.56 -23.5 66.22 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.848 0.356 . . . . 1.22 111.776 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -80.41 -26.59 38.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.097 0.475 . . . . 3.05 110.622 176.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.551 ' HB3' HG21 ' A' ' 32' ' ' VAL . 18.4 mmtt -91.95 -58.91 2.25 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.977 -0.556 . . . . 1.48 111.058 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.5 t -131.02 104.15 15.36 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-O 121.294 0.569 . . . . 1.16 109.493 -175.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -48.08 -52.9 7.48 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 123.645 2.897 . . . . 0.58 112.129 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -61.31 -41.38 96.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 114.612 -1.176 . . . . 2.45 112.196 -178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.8 mt -70.7 -40.01 73.11 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 119.443 -0.903 . . . . 1.42 109.639 -173.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.69 -36.6 93.51 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 114.614 -1.175 . . . . 0.37 111.61 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.82 94.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.719 0.295 . . . . 0.48 110.652 175.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -56.99 -59.66 4.73 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.926 -0.579 . . . . 2.17 110.911 177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.6 p -63.97 -32.91 59.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.421 . . . . 1.12 111.744 -177.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.603 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.5 OUTLIER -62.52 -55.61 25.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.822 0.344 . . . . 1.7 110.484 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 69' ' ' MET . 9.0 mtpm? -67.42 -33.09 74.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.548 0.69 . . . . 3.96 110.104 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 17' ' ' GLU . 15.2 tp -66.52 -50.38 63.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.959 -1.019 . . . . 1.5 111.83 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.503 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.9 OUTLIER -74.57 -21.73 59.35 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.185 -0.672 . . . . 2.34 109.185 -174.433 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.12 -41.49 99.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.905 -1.043 . . . . 0.4 110.648 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 28.4 mtm -63.45 -44.3 94.9 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.483 -0.562 . . . . 0.72 109.483 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.42 -49.21 78.13 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 114.996 -1.002 . . . . 0.79 110.299 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -62.45 -36.69 83.23 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 115.554 -0.748 . . . . 1.47 111.517 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.2 m -63.79 -41.12 98.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.92 0.39 . . . . 1.26 111.211 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 60.2 mttp -67.96 -44.88 75.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.213 -0.449 . . . . 1.54 110.039 177.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.4 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 79.1 mt -68.48 -22.57 27.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.456 0.646 . . . . 0.34 110.614 177.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -34.14 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.791 0.805 . . . . 0.35 109.744 177.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.46 -2.04 56.61 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.421 -1.263 . . . . 0.49 110.397 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 9.9 tp -93.82 134.77 35.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.403 -0.817 . . . . 0.71 110.114 -174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.39 155.41 40.18 Favored Glycine 0 C--O 1.225 -0.445 0 CA-C-O 119.669 -0.517 . . . . 0.76 112.619 -177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_exo -43.19 -43.21 10.06 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 124.072 3.182 . . . . 1.56 114.49 -173.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -66.22 -54.13 28.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.719 0.295 . . . . 2.52 110.265 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.67 -32.0 63.75 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.462 -0.495 . . . . 0.36 110.59 -174.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.4 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.5 ttpt -61.53 -51.94 66.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.918 -0.583 . . . . 2.04 111.341 176.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.04 -34.62 89.55 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.356 -0.926 . . . . 0.41 111.214 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -67.86 -49.1 64.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.029 -0.585 . . . . 1.65 112.252 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.0 -49.44 63.33 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.762 -0.654 . . . . 0.41 111.753 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -69.75 -20.5 63.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.899 -0.591 . . . . 1.96 111.142 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 14.4 tppt? -90.22 -42.28 11.11 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.079 0.466 . . . . 2.12 111.074 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -71.43 -43.78 66.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.99 0.424 . . . . 0.57 110.998 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.471 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 77.9 mt -67.85 -30.37 48.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.455 . . . . 1.09 111.935 -179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 10.6 pt-20 -67.15 -28.73 68.37 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 120.15 -0.62 . . . . 2.82 109.981 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.1 mt -67.29 -45.15 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 109.401 -0.592 . . . . 0.51 109.401 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.25 -39.16 91.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.79 -0.641 . . . . 0.64 110.604 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.471 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 19.1 mtm180 -68.41 -28.75 67.36 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.645 -0.707 . . . . 4.42 110.617 177.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -73.78 -31.67 60.03 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.266 -0.492 . . . . 0.66 112.351 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.16 -50.63 76.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.034 0.445 . . . . 0.55 110.274 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.467 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 20.9 pttp -79.28 -7.71 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 2.7 110.942 178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.407 ' HA ' ' HD2' ' A' ' 100' ' ' TYR . . . -70.43 -33.76 71.7 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.425 -0.583 . . . . 0.63 109.425 168.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.633 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 78.6 mtp180 -85.44 -3.94 59.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.805 -0.634 . . . . 3.1 110.0 175.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 20.5 m-85 -88.25 -32.21 18.64 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 119.988 -0.685 . . . . 0.97 109.457 166.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.538 ' CE1' HD21 ' A' ' 22' ' ' LEU . 35.2 m-85 -69.6 -54.66 12.95 Favored 'General case' 0 N--CA 1.46 0.047 0 CA-C-O 121.022 0.439 . . . . 1.48 110.631 176.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.404 ' CG2' ' HB3' ' A' ' 37' ' ' PHE . 33.0 p -61.21 -26.92 68.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.273 0.842 . . . . 0.87 113.273 -172.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 103.47 -10.7 53.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.62 -0.8 . . . . 1.16 112.141 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.633 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 91.5 m-20 -85.07 57.95 4.74 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.302 -0.258 . . . . 1.83 110.302 -178.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -49.93 125.61 18.26 Favored Pre-proline 0 N--CA 1.464 0.251 0 N-CA-C 112.797 0.666 . . . . 1.75 112.797 -172.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.33 142.75 30.56 Favored 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.811 2.341 . . . . 0.53 111.324 175.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 15.2 t -78.18 169.47 18.21 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.493 -0.558 . . . . 1.48 109.493 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.416 ' HB2' ' NZ ' ' A' ' 107' ' ' LYS . 4.3 ttmp? -61.33 -34.59 75.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 118.26 0.482 . . . . 2.88 110.648 -174.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -65.35 -30.21 71.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.798 -0.637 . . . . 2.24 110.982 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -63.56 -40.21 96.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.246 0.546 . . . . 1.73 110.235 176.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.639 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -71.39 -42.42 68.41 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.515 -0.766 . . . . 0.82 110.652 179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -55.76 -42.73 75.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.094 0.473 . . . . 1.74 110.068 176.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.538 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -67.51 -39.08 85.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.854 -0.612 . . . . 0.47 112.337 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.52 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 3.9 p -74.29 -33.31 63.21 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.436 0.532 . . . . 1.34 112.436 -176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.703 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -74.3 -27.41 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 107.83 -1.174 . . . . 0.65 107.83 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.598 ' HG3' ' OE1' ' A' ' 154' ' ' GLU . 23.0 ttmm -64.24 -35.42 80.78 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.882 -1.508 . . . . 1.72 110.775 177.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.442 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.5 mt-10 -77.02 -40.05 47.98 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.112 -0.635 . . . . 2.27 111.076 178.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.429 HG22 ' O ' ' A' ' 114' ' ' VAL . 5.5 m -66.79 -24.62 32.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.359 -0.536 . . . . 0.81 110.229 178.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.441 HD13 ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -84.19 -37.83 21.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.387 -0.37 . . . . 1.21 111.117 171.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 116' ' ' GLU . 36.5 ttpt -55.86 -44.12 77.77 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.297 -1.001 . . . . 0.95 108.297 176.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.4 mp -69.25 -54.47 14.56 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-N 113.947 -1.478 . . . . 1.06 111.867 174.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -69.37 -31.31 69.63 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 119.684 -0.806 . . . . 1.54 111.803 -167.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 64.0 mmtt -66.33 -28.44 68.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.848 0.356 . . . . 1.98 110.976 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.83 -3.36 58.89 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.167 0.803 . . . . 0.7 113.167 -173.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.0 mtm -77.4 158.18 30.2 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 119.851 -0.74 . . . . 0.5 110.663 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 34.6 t -66.18 149.73 49.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.796 -0.446 . . . . 1.18 109.796 175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -53.11 -43.75 67.12 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.603 0.24 . . . . 2.21 111.266 -176.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -70.02 -34.91 73.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.42 110.973 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -67.5 -45.14 80.37 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.952 -0.567 . . . . 0.31 112.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -74.73 -24.97 58.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.79 0.328 . . . . 1.32 110.485 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.86 -45.28 94.48 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.538 0.685 . . . . 0.42 110.509 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -72.15 -28.93 63.56 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.859 -1.064 . . . . 0.55 109.679 -176.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -62.19 -30.05 70.79 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.324 -0.853 . . . . 0.39 109.295 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.09 -7.24 88.58 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.664 -0.698 . . . . 0.27 112.936 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -88.98 -40.98 12.64 Favored 'General case' 0 N--CA 1.443 -0.825 0 CA-C-O 121.342 0.591 . . . . 2.43 110.155 175.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.457 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 8.6 mm100 -85.98 -30.34 22.82 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.091 -0.959 . . . . 1.83 110.57 -177.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -132.96 70.86 78.53 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-O 121.057 0.456 . . . . 0.69 110.635 173.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.24 -27.28 72.21 Favored 'Trans proline' 0 C--N 1.35 0.652 0 C-N-CA 122.953 2.435 . . . . 0.63 112.088 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 25.8 t80 -66.34 -39.49 89.24 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.799 -0.637 . . . . 2.31 110.399 -178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 71.6 mt -83.3 -42.11 17.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.105 -0.498 . . . . 1.02 110.793 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.81 -34.31 71.37 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.475 -0.565 . . . . 0.35 109.475 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 28.6 tptp -50.5 -75.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.163 -0.926 . . . . 2.58 111.633 171.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.461 HG21 ' HA ' ' A' ' 13' ' ' LEU . 1.5 m -63.68 -27.64 43.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.794 -0.639 . . . . 0.5 112.616 -172.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.79 -44.94 69.05 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.382 -0.527 . . . . 0.62 110.446 -179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -83.17 -27.27 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.401 -0.363 . . . . 2.58 111.265 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 9.7 t -71.51 -19.59 62.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.927 0.394 . . . . 1.32 110.67 -178.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 102.74 -10.35 55.85 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.619 -0.801 . . . . 1.09 112.583 178.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.547 ' HG3' HD21 ' A' ' 13' ' ' LEU . 46.2 tptt -54.55 -48.15 72.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.854 0.359 . . . . 1.98 110.79 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.408 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -75.36 -44.77 43.27 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.24 -0.436 . . . . 0.34 110.922 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -56.13 -40.07 73.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.696 -0.684 . . . . 0.51 112.611 -175.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 4.8 mptp? -83.41 -16.55 45.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.913 0.387 . . . . 2.82 110.901 -177.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -78.81 -35.13 44.64 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.45 -0.574 . . . . 0.49 109.45 172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.703 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.58 -27.25 51.34 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.754 -0.657 . . . . 0.59 110.955 176.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 61.4 75.76 0.28 Allowed Glycine 0 C--O 1.237 0.289 0 C-N-CA 120.945 -0.645 . . . . 1.62 111.958 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.648 ' HG3' HD22 ' A' ' 155' ' ' ASN . 8.6 pt-20 -159.05 9.46 0.13 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.715 0.635 . . . . 4.12 112.715 -175.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.648 HD22 ' HG3' ' A' ' 154' ' ' GLU . 10.2 p30 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.494 -0.765 . . . . 4.01 109.548 -175.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 120.785 0.326 . . . . 23.59 110.553 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -94.48 -35.18 6.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.634 -0.794 . . . . 22.47 112.663 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 26.1 t -80.68 105.31 11.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.049 0.452 . . . . 21.51 110.22 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 4.0 p -79.41 58.97 2.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.356 0.598 . . . . 20.19 111.493 -178.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 56.9 m80 -117.21 1.9 12.52 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.445 0.64 . . . . 21.42 109.38 173.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -159.16 129.06 5.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.164 -0.925 . . . . 18.2 109.727 -177.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -105.11 103.36 12.89 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.667 -0.494 . . . . 16.06 109.667 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -73.12 137.94 45.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.229 -0.441 . . . . 13.27 110.503 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -80.88 95.13 6.63 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.428 -0.582 . . . . 12.33 109.428 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 46.1 m80 -65.36 -18.45 65.32 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.622 -0.717 . . . . 11.33 110.712 -175.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 2.5 m -66.73 -19.11 65.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.791 -0.64 . . . . 7.95 110.927 177.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 39.8 m -89.99 -5.74 56.35 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.258 -0.428 . . . . 7.36 110.892 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -66.47 -62.05 4.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.819 -0.705 . . . . 4.57 111.565 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -90.73 102.53 15.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.361 -0.607 . . . . 4.52 109.361 175.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 28.1 ttm -102.4 109.81 21.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.37 -0.377 . . . . 2.0 110.718 -179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.457 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 55.2 t80 -44.41 129.95 6.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.285 -0.87 . . . . 1.47 112.179 175.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.401 ' HE3' ' OE1' ' A' ' 4' ' ' GLU . 1.6 tmtm? -123.12 114.91 20.96 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.647 -0.706 . . . . 3.15 109.21 177.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -68.35 -24.07 64.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.314 0.578 . . . . 2.35 110.204 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.401 ' OE1' ' HE3' ' A' ' 2' ' ' LYS . 44.8 mt-10 -86.1 -2.73 58.6 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.59 -0.732 . . . . 4.16 110.394 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -94.08 -10.76 32.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.549 0.69 . . . . 2.57 109.529 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.0 mt -80.74 131.6 60.16 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.345 -0.843 . . . . 0.69 109.021 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -37.81 115.36 0.17 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.745 2.964 . . . . 0.6 112.679 178.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.17 -17.78 64.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.012 -0.54 . . . . 0.57 111.551 -174.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -74.67 -26.58 59.95 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.92 0.867 . . . . 1.37 109.299 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 65.4 t80 -85.13 -31.42 23.31 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.228 -1.351 . . . . 0.8 110.656 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 67.5 mtp180 -67.88 -18.55 64.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.301 0.572 . . . . 1.73 110.028 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.71 -21.64 64.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.185 -0.916 . . . . 1.02 110.748 175.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.543 HD21 ' HD2' ' A' ' 147' ' ' LYS . 90.7 mt -87.4 -6.99 58.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.069 -0.514 . . . . 0.93 110.916 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 63.6 mtt -86.75 126.98 61.87 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.341 -0.391 . . . . 1.15 110.63 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -75.35 155.39 41.31 Favored 'Trans proline' 0 N--CA 1.459 -0.507 0 C-N-CA 122.36 2.04 . . . . 0.9 111.572 175.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.17 -49.37 7.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.577 2.851 . . . . 0.96 113.492 -176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -51.36 -51.42 54.7 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.831 0.348 . . . . 1.83 111.605 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.34 -28.18 66.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.809 0.337 . . . . 0.82 111.405 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 -76.55 -39.01 54.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.359 -0.382 . . . . 2.16 110.465 178.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -46.71 -55.38 7.87 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 123.934 0.771 . . . . 1.06 110.976 -178.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' HB2' HD22 ' A' ' 66' ' ' LEU . 40.8 t80 -56.43 -63.39 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.673 -0.694 . . . . 0.65 112.366 -179.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 40.5 mt -75.1 -5.36 43.78 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 119.223 0.92 . . . . 1.13 111.72 -174.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -74.41 -37.49 63.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.008 0.432 . . . . 2.06 110.377 162.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -65.37 -48.09 74.14 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.786 -0.643 . . . . 1.84 111.717 -177.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.405 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.6 mm? -57.59 137.09 56.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.195 0.522 . . . . 1.05 110.578 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.2 m -131.58 -64.22 0.8 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.683 -0.689 . . . . 1.78 111.93 -174.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 2.7 p-10 -135.76 -90.49 0.3 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.599 0.592 . . . . 2.39 112.599 -173.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.402 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -62.54 -19.73 60.58 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 114.153 0.421 . . . . 0.93 114.153 -171.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.574 ' O ' HG12 ' A' ' 32' ' ' VAL . 36.6 m-20 -76.82 -34.82 57.88 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.983 0.391 . . . . 2.25 110.93 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 1' ' ' PHE . 95.7 mttt -65.67 -27.38 68.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.524 0.678 . . . . 1.31 110.487 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 66.0 m -60.71 -38.18 84.17 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.917 -1.038 . . . . 0.8 111.246 176.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.623 HG21 ' HB3' ' A' ' 55' ' ' LYS . 6.2 p -89.91 -21.87 6.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.982 -0.554 . . . . 0.85 111.581 -173.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.48 ' HG ' ' CZ ' ' A' ' 100' ' ' TYR . 3.1 mm? -50.41 -50.91 50.46 Favored 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 111.804 0.298 . . . . 0.98 111.804 172.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 9.2 ptpp? -65.72 -25.02 67.11 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.809 0.338 . . . . 2.41 111.395 -176.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -70.55 -31.58 68.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.224 0.535 . . . . 1.96 109.891 176.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 89.7 t -74.71 -51.19 23.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.489 -0.778 . . . . 0.98 110.19 175.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -53.69 -42.79 68.37 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.233 0.827 . . . . 0.83 113.233 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.41 21.55 2.85 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.876 -0.73 . . . . 2.18 111.023 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -122.11 12.38 10.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.827 -0.624 . . . . 1.56 110.081 172.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -79.03 -156.82 10.41 Favored Glycine 0 N--CA 1.45 -0.401 0 CA-C-N 115.71 -0.677 . . . . 1.54 112.19 177.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.69 165.12 84.61 Favored 'Cis proline' 0 C--N 1.343 0.281 0 C-N-CA 123.809 -1.33 . . . . 1.68 112.981 0.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.462 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 54.7 m-85 -123.12 124.81 43.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.604 -0.725 . . . . 1.28 110.379 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -79.68 -20.53 46.37 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.211 -0.904 . . . . 3.51 110.575 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.516 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.4 p30 -144.75 174.27 11.13 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.142 -0.481 . . . . 1.52 110.889 -171.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.1 m -72.06 -39.5 69.0 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.482 -0.326 . . . . 1.18 111.091 -178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -59.05 -42.29 89.92 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.101 -0.499 . . . . 2.24 111.751 -172.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.7 mt-10 -54.96 -39.57 69.08 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.802 0.334 . . . . 2.26 111.485 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.7 m -72.71 -42.09 64.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.245 -0.434 . . . . 1.19 110.442 -179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 60.7 mt -65.46 -38.33 82.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.55 110.281 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.58 -52.51 64.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.375 -0.829 . . . . 0.57 111.186 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.74 77.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.752 -0.658 . . . . 0.5 110.328 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.489 HD22 HD22 ' A' ' 59' ' ' LEU . 37.1 mt -70.3 -40.66 74.11 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.12 -0.946 . . . . 0.45 111.41 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -66.52 -23.49 66.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.064 0.459 . . . . 1.22 111.26 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.33 -50.98 10.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.973 -0.558 . . . . 3.05 109.92 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 51.7 mmtt -67.35 -62.21 1.54 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.784 -0.643 . . . . 1.48 111.909 179.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -132.33 90.8 33.14 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 116.043 -0.526 . . . . 1.16 109.895 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -41.55 -57.51 1.43 Allowed 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.829 3.019 . . . . 0.58 113.685 -171.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 30.5 tt0 -62.69 -27.03 68.97 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.234 -0.894 . . . . 2.45 111.982 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 2.2 tt -70.79 -46.25 63.2 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.786 -1.19 . . . . 1.42 107.786 -178.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -64.98 -32.07 83.02 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 114.407 -1.269 . . . . 0.37 111.318 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.59 -39.43 91.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.666 0.269 . . . . 0.48 110.457 174.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 61.7 mttp -54.54 -53.4 54.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.995 -0.548 . . . . 2.17 110.125 175.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.503 HG22 ' CE1' ' A' ' 21' ' ' PHE . 1.8 t -65.25 -41.61 91.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.708 -0.678 . . . . 1.12 111.02 -179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -59.39 -55.19 37.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.785 -0.643 . . . . 1.7 110.698 -177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' A' ' 69' ' ' MET . 8.6 mtpm? -63.48 -41.14 98.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.343 0.592 . . . . 3.96 110.304 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 70' ' ' VAL . 16.4 tp -62.97 -50.59 70.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.331 -0.85 . . . . 1.5 112.298 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.6 ' O ' HG22 ' A' ' 70' ' ' VAL . 1.4 p80 -77.23 -17.23 58.62 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.881 -0.785 . . . . 2.34 108.881 -172.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.0 81.12 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.625 -0.716 . . . . 0.4 109.879 173.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 21.5 mtm -67.86 -46.85 70.56 Favored 'General case' 0 CA--C 1.516 -0.338 0 N-CA-C 109.281 -0.637 . . . . 0.72 109.281 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 66' ' ' LEU . 2.3 m -62.13 -35.27 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 CA-C-N 115.625 -0.716 . . . . 0.79 109.832 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -65.42 -41.99 92.96 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 116.004 -0.544 . . . . 1.47 110.663 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 43.7 m -59.71 -29.72 68.3 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.197 0.523 . . . . 1.26 110.459 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 87.7 mttt -82.11 -47.01 13.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.557 -0.747 . . . . 1.54 110.837 177.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.1 mt -66.9 -30.43 49.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.34 111.418 179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.03 -31.12 71.82 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.475 0.655 . . . . 0.35 110.274 175.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.82 -43.47 58.69 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 114.836 -1.074 . . . . 0.49 110.669 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.579 ' CD2' ' HA ' ' A' ' 132' ' ' PHE . 97.4 mt -43.59 140.39 1.8 Allowed 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 112.74 0.644 . . . . 0.71 112.74 175.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.87 159.6 39.23 Favored Glycine 0 N--CA 1.437 -1.242 0 N-CA-C 110.592 -1.003 . . . . 0.76 110.592 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -43.5 -35.82 6.32 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.561 2.841 . . . . 1.56 113.522 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.0 -48.35 37.15 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.523 -0.308 . . . . 2.52 111.15 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.439 ' HB1' HD22 ' A' ' 77' ' ' LEU . . . -72.41 -34.87 68.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.333 0.587 . . . . 0.36 110.146 -174.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -58.38 -44.66 88.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.878 -1.055 . . . . 2.04 110.741 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.66 -43.97 97.28 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.167 -0.539 . . . . 0.41 112.54 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -66.87 -44.09 81.83 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.529 0.204 . . . . 1.65 110.951 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.69 -46.64 81.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.131 0.491 . . . . 0.41 111.28 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.591 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 45.5 mt-10 -66.32 -42.43 88.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.66 -0.7 . . . . 1.96 110.529 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.09 -46.94 69.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.396 -0.366 . . . . 2.12 111.134 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.1 p -60.39 -39.88 88.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.762 0.315 . . . . 0.57 110.757 -177.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 25.1 mt -65.5 -39.69 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 116.392 -0.367 . . . . 1.09 110.818 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.591 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 54.4 mt-10 -56.62 -48.21 77.97 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.069 0.461 . . . . 2.82 110.361 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.421 HG22 ' HB2' ' A' ' 113' ' ' SER . 74.5 mt -64.59 -44.23 96.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.471 -0.786 . . . . 0.51 110.892 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.6 66.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.05 0.452 . . . . 0.64 110.941 179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -62.89 -38.72 92.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.987 -0.551 . . . . 4.42 110.78 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -71.74 -39.31 60.2 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.06 -0.591 . . . . 0.66 113.065 -175.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.41 -54.1 38.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.854 0.359 . . . . 0.55 110.779 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.474 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -87.17 29.94 0.81 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 2.7 110.07 178.089 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -112.83 -34.85 5.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.994 -1.003 . . . . 0.63 108.755 164.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -80.9 -13.38 58.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.666 -0.697 . . . . 3.1 109.798 177.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.411 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 20.1 m-85 -77.38 -34.05 55.05 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.463 -0.569 . . . . 0.97 109.463 167.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.48 ' CZ ' ' HG ' ' A' ' 33' ' ' LEU . 1.2 m-85 -77.83 -35.92 50.65 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.956 0.724 . . . . 1.48 112.956 -175.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -65.04 -9.63 23.54 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.586 0.587 . . . . 0.87 112.586 -174.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.89 14.68 22.42 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.754 -0.736 . . . . 1.16 111.531 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -117.88 -177.73 3.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.932 -0.396 . . . . 1.83 109.932 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.451 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 38.4 mt-10 -142.52 105.19 5.45 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.318 -0.401 . . . . 1.75 110.729 178.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.1 Cg_endo -58.1 143.85 95.94 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 121.835 1.69 . . . . 0.53 110.133 170.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 77.6 p -76.04 170.21 16.71 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.851 -0.426 . . . . 1.48 109.851 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.512 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.4 tptm -64.16 -30.37 71.44 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.136 -0.69 . . . . 2.88 109.136 178.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -69.86 -30.11 67.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.373 -0.831 . . . . 2.24 110.81 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -60.57 -46.28 90.81 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 109.801 -0.444 . . . . 1.73 109.801 173.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.5 mp -65.77 -44.94 84.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.529 -0.76 . . . . 0.82 110.918 178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 57.6 mtpt -59.41 -39.97 85.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.173 0.511 . . . . 1.74 110.445 179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 115' ' ' LYS . . . -69.4 -42.89 74.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.727 -0.669 . . . . 0.47 111.413 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.421 ' HB2' HG22 ' A' ' 91' ' ' ILE . 51.2 p -61.79 -38.16 87.02 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.072 -0.251 . . . . 1.34 111.558 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.639 ' O ' HG22 ' A' ' 117' ' ' VAL . 7.8 m -80.76 -25.83 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.395 0.617 . . . . 0.65 109.447 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 112' ' ' ALA . 41.1 ttmt -55.95 -44.56 78.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.701 -0.681 . . . . 1.72 110.994 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.511 ' O ' HD13 ' A' ' 120' ' ' LEU . 24.0 mt-10 -72.71 -34.21 66.98 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.271 -0.572 . . . . 2.27 111.006 -176.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.4 m -66.16 -34.03 67.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.144 -0.622 . . . . 0.81 110.505 178.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.498 HD12 ' HE3' ' A' ' 122' ' ' LYS . 4.1 mm? -73.19 -33.78 65.59 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 121.923 -0.486 . . . . 1.21 110.313 172.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 116' ' ' GLU . 35.4 ttpt -59.01 -45.64 90.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.996 -0.742 . . . . 0.95 108.996 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -72.27 -49.9 31.29 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.663 -1.153 . . . . 1.06 111.53 176.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.422 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 42.4 t80 -69.79 -37.47 76.33 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 119.849 -0.741 . . . . 1.54 111.747 -168.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.498 ' HE3' HD12 ' A' ' 118' ' ' LEU . 93.0 mttt -64.46 -29.88 70.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.931 0.396 . . . . 1.98 110.896 178.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -82.17 -6.68 59.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.699 -0.682 . . . . 0.7 112.397 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.407 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 42.2 mtm -76.72 157.08 31.99 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.119 -0.633 . . . . 0.5 110.313 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 70.5 m -70.06 153.39 43.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 121.06 -0.256 . . . . 1.18 110.705 175.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -54.97 -46.07 75.04 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.168 0.433 . . . . 2.21 112.168 -172.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.51 -34.7 75.96 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.775 0.322 . . . . 0.42 111.076 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -68.14 -38.11 87.72 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.016 -0.538 . . . . 0.31 112.143 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.422 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 99.8 mttt -64.73 -46.39 82.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.323 0.582 . . . . 1.32 110.154 177.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.05 -34.41 77.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.134 -0.939 . . . . 0.42 111.443 -178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -74.18 -31.66 62.77 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.683 -0.488 . . . . 0.55 109.683 -178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.579 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . 89.7 t80 -64.07 -34.45 78.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.777 -0.647 . . . . 0.39 110.674 175.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.21 -4.91 57.79 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.133 -0.556 . . . . 0.27 113.475 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -91.59 -23.14 19.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.567 0.699 . . . . 2.43 110.088 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.614 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -108.81 -35.82 6.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.052 -0.976 . . . . 1.83 110.889 -173.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -128.77 71.61 81.24 Favored Pre-proline 0 C--N 1.32 -0.711 0 N-CA-C 109.256 -0.646 . . . . 0.69 109.256 171.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.88 -33.88 62.53 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 123.016 2.478 . . . . 0.63 112.75 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.621 ' O ' HG13 ' A' ' 142' ' ' VAL . 28.6 m-85 -65.98 -30.55 71.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.448 -0.342 . . . . 2.31 111.492 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.4 ' HG ' ' CE1' ' A' ' 143' ' ' PHE . 5.9 mp -77.48 -48.23 17.63 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.399 -0.52 . . . . 1.02 110.028 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.16 -31.55 65.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.545 0.688 . . . . 0.35 109.854 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 56.2 tttp -58.41 -75.09 0.05 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.804 -1.089 . . . . 2.58 111.43 171.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.5 m -64.5 -26.68 40.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 112.895 0.702 . . . . 0.5 112.895 -172.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.4 ' CE1' ' HG ' ' A' ' 139' ' ' LEU . 3.8 m-85 -71.63 -47.89 51.52 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.682 -0.407 . . . . 0.62 110.478 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -78.24 -23.91 47.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.113 -0.494 . . . . 2.58 111.188 -178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.7 t -70.71 -19.29 62.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.254 0.55 . . . . 1.32 109.775 174.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.471 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 96.86 -9.62 66.01 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.973 -0.632 . . . . 1.09 112.582 177.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.543 ' HD2' HD21 ' A' ' 13' ' ' LEU . 8.8 tmtm? -57.14 -50.7 71.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.807 0.337 . . . . 1.98 110.408 -176.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.85 -40.5 83.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.34 111.092 -178.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -62.16 -35.97 80.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.126 -0.488 . . . . 0.51 111.812 179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 14.4 mmmm -75.36 -35.42 61.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.88 0.371 . . . . 2.82 110.352 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.446 ' HD1' HG21 ' A' ' 114' ' ' VAL . 22.2 t80 -61.77 -40.57 95.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.772 -0.649 . . . . 0.49 109.705 173.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.416 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -64.88 -42.37 94.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.602 -0.727 . . . . 0.59 111.133 177.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 64.84 50.01 60.49 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.731 -0.747 . . . . 1.62 111.587 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.45 17.73 8.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.992 0.425 . . . . 4.12 110.983 -176.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.038 0 CA-C-N 116.047 -0.524 . . . . 4.01 110.215 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 120.855 0.36 . . . . 23.59 110.44 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 172.41 161.75 23.41 Favored Glycine 0 N--CA 1.444 -0.782 0 N-CA-C 111.391 -0.684 . . . . 22.47 111.391 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 21.9 m -81.08 59.03 3.69 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 21.51 111.082 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 9.4 t -102.84 60.88 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.334 0.588 . . . . 20.19 109.626 178.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -129.45 102.5 6.42 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.657 -0.701 . . . . 21.42 109.454 176.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -56.19 124.91 19.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.203 -0.453 . . . . 18.2 111.267 -179.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -147.39 55.3 1.09 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.613 0.72 . . . . 16.06 110.045 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 -62.1 111.66 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.158 -0.928 . . . . 13.27 110.199 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 30.7 m-70 -58.94 111.45 1.31 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.837 -0.619 . . . . 12.33 111.386 -177.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -136.71 30.06 2.86 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.512 -0.767 . . . . 11.33 109.151 177.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . 0.457 ' HB2' ' SD ' ' A' ' 0' ' ' MET . 6.2 p -133.76 79.41 1.82 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.154 -0.93 . . . . 7.95 111.263 -174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 40.0 m -140.99 41.47 1.81 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.288 0.566 . . . . 7.36 110.077 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -131.76 -50.0 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.65 -0.785 . . . . 4.57 112.275 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -132.61 50.42 2.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.614 0.245 . . . . 4.52 111.043 -177.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.457 ' SD ' ' HB2' ' A' ' -4' ' ' SER . 89.1 mmm -101.39 128.8 47.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.875 0.369 . . . . 2.0 110.06 177.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -75.91 138.85 41.3 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.525 0.678 . . . . 1.47 110.906 -178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -107.88 138.11 44.71 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.71 -0.677 . . . . 3.15 109.584 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.5 t80 -70.72 -17.26 62.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.433 0.635 . . . . 2.35 109.619 -179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -92.74 2.35 56.79 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.31 -0.859 . . . . 4.16 110.127 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -106.38 -16.15 14.63 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.045 -0.525 . . . . 2.57 110.134 178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.6 mt -76.6 133.9 70.06 Favored Pre-proline 0 C--N 1.328 -0.348 0 N-CA-C 108.319 -0.993 . . . . 0.69 108.319 175.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -43.06 116.2 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.298 2.665 . . . . 0.6 112.875 -176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.74 -22.56 67.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.983 -0.553 . . . . 0.57 111.491 -175.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.24 -34.45 78.04 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.129 0.966 . . . . 1.37 108.925 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.427 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 64.5 t80 -85.37 -24.57 27.51 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 113.673 -1.603 . . . . 0.8 110.49 -176.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -71.78 -20.46 61.86 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.401 0.62 . . . . 1.73 109.467 177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -70.61 -19.08 62.87 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.932 -1.031 . . . . 1.02 110.371 175.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.458 HD21 ' HG3' ' A' ' 147' ' ' LYS . 61.8 mt -96.39 12.98 29.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.593 -0.731 . . . . 0.93 110.304 178.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 59.8 mtt -100.42 128.75 29.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.217 -0.447 . . . . 1.15 110.604 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 21.0 Cg_endo -62.68 137.35 63.24 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.379 2.053 . . . . 0.9 110.746 175.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.2 Cg_exo -50.49 -29.58 24.93 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.779 2.986 . . . . 0.96 113.656 -175.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.517 ' O ' HD11 ' A' ' 66' ' ' LEU . 20.2 mp0 -64.54 -50.19 68.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.072 0.463 . . . . 1.83 110.236 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.18 -29.59 69.32 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.554 . . . . 0.82 110.796 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.7 mtm180 -68.55 -45.56 71.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.524 . . . . 2.16 110.389 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.43 -41.13 65.74 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 123.45 0.469 . . . . 1.06 111.436 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.555 ' O ' HD23 ' A' ' 25' ' ' LEU . 34.2 t80 -60.59 -68.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.849 -0.614 . . . . 0.65 111.222 177.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.559 HD21 ' CE1' ' A' ' 100' ' ' TYR . 69.4 mt -70.01 -6.97 37.12 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 119.2 0.909 . . . . 1.13 112.069 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.81 -53.19 50.73 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.518 0.199 . . . . 2.06 110.801 163.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -81.0 -31.65 34.59 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.483 0.549 . . . . 1.84 112.483 -173.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -56.41 131.12 47.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.711 0.767 . . . . 1.05 111.023 173.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.1 m -124.37 178.61 5.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.593 -1.185 . . . . 1.78 109.374 -176.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.77 -47.29 64.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.798 0.333 . . . . 2.39 111.644 -175.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.59 -48.75 79.3 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.959 -0.639 . . . . 0.93 112.538 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.614 ' O ' HG12 ' A' ' 32' ' ' VAL . 15.1 m-20 -65.89 -43.96 86.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.708 0.29 . . . . 2.25 110.999 -178.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.07 -17.58 57.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.438 -0.346 . . . . 1.31 111.534 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 49.3 m -64.77 -43.64 92.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.454 0.645 . . . . 0.8 109.888 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.614 HG12 ' O ' ' A' ' 29' ' ' ASP . 2.8 p -79.21 -29.69 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 CA-C-N 115.262 -0.881 . . . . 0.85 110.082 -176.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.507 HD13 HD21 ' A' ' 52' ' ' LEU . 4.2 mm? -54.88 -42.41 72.04 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-O 121.044 0.45 . . . . 0.98 110.167 169.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.496 ' HA ' HG22 ' A' ' 101' ' ' THR . 63.3 tttp -62.99 -29.64 70.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 2.41 111.019 -179.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -77.99 -24.98 47.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.995 0.426 . . . . 1.96 110.81 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.0 t -80.9 -57.2 5.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.717 0.77 . . . . 0.98 110.009 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.412 ' HE1' HD12 ' A' ' 33' ' ' LEU . 17.8 m-85 -54.52 -42.55 70.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.652 -1.158 . . . . 0.83 114.116 177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.638 ' HE3' ' OG1' ' A' ' 101' ' ' THR . 5.1 mmpt? -86.1 8.27 21.48 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 119.966 -0.694 . . . . 2.18 111.346 -177.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -102.8 -77.98 0.55 Allowed 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.512 -0.767 . . . . 1.56 108.975 169.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.439 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 44.56 -151.79 0.65 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 120.99 -0.624 . . . . 1.54 112.947 -175.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -91.0 145.27 15.05 Favored 'Cis proline' 0 N--CA 1.457 -0.67 0 CA-C-N 118.716 1.258 . . . . 1.68 111.421 -8.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.439 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 22.7 m-85 -112.18 120.42 41.72 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.472 0.653 . . . . 1.28 111.35 -173.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -81.13 -19.2 44.05 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.822 -1.081 . . . . 3.51 110.649 178.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.416 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -146.09 160.03 42.47 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.955 -0.566 . . . . 1.52 109.548 -174.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.457 ' O ' HG13 ' A' ' 49' ' ' ILE . 10.0 m -66.29 -30.57 71.02 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.231 -0.441 . . . . 1.18 111.947 -174.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 41.0 tt0 -59.58 -39.45 84.15 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.968 -0.105 . . . . 2.24 111.234 -177.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 43.7 mt-10 -60.55 -46.38 90.4 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.615 -0.266 . . . . 2.26 111.311 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.5 p -65.76 -34.32 77.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 1.19 110.919 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 45' ' ' THR . 88.6 mt -67.2 -41.79 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.213 0.53 . . . . 0.55 110.21 177.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.535 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -57.4 -51.76 68.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.071 -0.968 . . . . 0.57 111.249 177.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.29 -42.56 77.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.261 0.553 . . . . 0.5 110.511 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 18.7 mt -66.64 -39.09 88.11 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.341 -0.845 . . . . 0.45 111.169 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -63.92 -31.02 72.06 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.775 0.321 . . . . 1.22 111.03 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 35.3 mmtp -73.99 -46.22 45.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.257 0.551 . . . . 3.05 110.293 177.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.465 ' HB3' HG21 ' A' ' 32' ' ' VAL . 61.0 mmtt -66.81 -59.0 3.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.526 -0.761 . . . . 1.48 111.737 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 m -140.65 101.98 6.54 Favored Pre-proline 0 C--N 1.311 -1.103 0 CA-C-O 121.274 0.559 . . . . 1.16 109.564 -176.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -43.52 -47.97 8.91 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 124.32 3.347 . . . . 0.58 112.798 -176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 11.7 pt-20 -62.86 -39.87 95.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.562 -1.199 . . . . 2.45 112.558 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.0 mt -72.22 -40.86 67.48 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-O 121.758 0.79 . . . . 1.42 109.418 -172.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.08 -34.18 89.26 Favored Glycine 0 N--CA 1.441 -1.005 0 CA-C-N 114.427 -1.261 . . . . 0.37 111.62 176.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.53 -38.14 80.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.748 0.309 . . . . 0.48 110.365 175.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.0 mmmt -58.01 -60.16 4.16 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.98 -0.555 . . . . 2.17 110.697 177.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -63.14 -34.18 65.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 1.12 111.309 -178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.417 ' HA ' HD13 ' A' ' 49' ' ' ILE . 40.5 tt0 -57.88 -66.06 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.266 -0.425 . . . . 1.7 111.237 178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 69' ' ' MET . 55.5 mtmt -67.04 -32.35 73.5 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.381 0.61 . . . . 3.96 110.641 -172.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.517 HD11 ' O ' ' A' ' 17' ' ' GLU . 1.4 tp -65.81 -47.03 76.43 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.21 -0.904 . . . . 1.5 111.196 178.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -22.57 55.55 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.584 -0.895 . . . . 2.34 108.584 -176.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.9 -30.23 68.67 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.022 -0.99 . . . . 0.4 110.773 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.463 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 31.3 mtm -65.76 -46.99 76.71 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.635 -0.876 . . . . 0.72 108.635 172.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.552 ' HA ' ' HD3' ' A' ' 73' ' ' LYS . 48.3 t -58.06 -44.16 86.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 114.446 -1.252 . . . . 0.79 110.098 176.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -63.94 -39.81 95.02 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.321 -0.854 . . . . 1.47 110.339 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.8 t -58.97 -49.3 78.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.073 -0.512 . . . . 1.26 111.459 179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -72.36 -36.27 68.72 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.056 -0.258 . . . . 1.54 111.017 -178.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.417 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.9 mt -67.08 -30.23 48.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.085 0.469 . . . . 0.34 110.676 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.43 -30.09 71.14 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.431 0.634 . . . . 0.35 110.493 173.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.35 -4.5 59.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.277 -0.874 . . . . 0.49 110.697 -178.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.423 HD13 ' HB2' ' A' ' 135' ' ' GLN . 7.4 tp -91.12 139.73 30.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.372 -0.831 . . . . 0.71 109.847 -176.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 155.61 53.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 121.019 -0.61 . . . . 0.76 111.967 -179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -44.5 -38.87 12.36 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.824 3.016 . . . . 1.56 113.835 -175.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -65.01 -57.02 9.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.116 0.484 . . . . 2.52 110.357 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -75.61 -32.37 60.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.36 110.961 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 38.3 ttpt -59.72 -39.5 84.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.669 -0.696 . . . . 2.04 110.726 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.78 -44.28 97.71 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.259 -0.972 . . . . 0.41 111.527 177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.8 t80 -65.4 -41.94 93.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.566 0.222 . . . . 1.65 111.134 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.38 -43.43 79.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.41 111.038 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -84.72 -21.22 30.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.309 -0.405 . . . . 1.96 110.756 -177.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 54.4 tptt -73.61 -45.12 54.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 120.949 0.404 . . . . 2.12 110.06 176.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.7 p -62.26 -34.21 76.1 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.231 -0.44 . . . . 0.57 110.616 177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.2 mt -68.77 -45.88 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.352 -0.386 . . . . 1.09 111.782 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.15 -29.31 70.69 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.59 -0.444 . . . . 2.82 110.922 -178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.9 mt -75.68 -44.9 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.15 0.5 . . . . 0.51 109.937 175.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.423 ' O ' ' HD3' ' A' ' 96' ' ' LYS . . . -64.54 -31.2 72.31 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.829 -0.623 . . . . 0.64 110.864 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 52.7 mtp180 -56.59 -51.89 66.93 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.092 -0.503 . . . . 4.42 110.582 175.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -64.8 -37.73 94.7 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.996 -0.621 . . . . 0.66 112.961 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.8 mm -63.83 -52.85 51.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.342 . . . . 0.55 111.095 -178.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 100' ' ' TYR . 9.9 mptt -83.86 -13.29 53.99 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.311 -0.556 . . . . 2.7 110.806 -177.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.82 -24.94 67.01 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 118.327 0.512 . . . . 0.63 110.101 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.3 mtp180 -87.77 -24.84 23.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.074 -0.512 . . . . 3.1 110.072 175.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -75.2 -37.97 60.95 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.97 109.796 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.559 ' CE1' HD21 ' A' ' 22' ' ' LEU . 3.3 m-85 -52.85 -27.58 19.03 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.544 -0.753 . . . . 1.48 112.838 -176.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.638 ' OG1' ' HE3' ' A' ' 38' ' ' LYS . 17.5 p -131.05 32.96 4.23 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 118.427 -1.309 . . . . 0.87 113.273 -176.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 79.62 1.41 86.65 Favored Glycine 0 CA--C 1.519 0.336 0 C-N-CA 120.699 -0.763 . . . . 1.16 114.003 170.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 90.4 m-20 -88.71 52.81 2.52 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.969 -0.752 . . . . 1.83 108.969 177.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.505 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 34.3 mt-10 -53.1 115.41 7.45 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 114.469 -1.241 . . . . 1.75 113.395 -169.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.505 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 19.4 Cg_endo -64.61 154.07 74.12 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.859 2.373 . . . . 0.53 111.178 172.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.454 HG23 ' H ' ' A' ' 108' ' ' ASP . 13.5 t -87.22 173.08 9.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.263 -0.643 . . . . 1.48 109.263 179.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 34.9 ttpt -64.69 -22.91 67.09 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.224 -0.59 . . . . 2.88 110.787 -175.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.454 ' H ' HG23 ' A' ' 106' ' ' THR . 18.2 m-20 -62.79 -44.16 96.91 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.175 -0.306 . . . . 2.24 110.175 175.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -57.26 -44.23 83.71 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.304 0.573 . . . . 1.73 110.214 177.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.9 mp -68.04 -48.53 65.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.126 -0.943 . . . . 0.82 111.213 -178.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 11.3 ptmm? -63.94 -32.39 73.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.018 0.437 . . . . 1.74 110.211 -177.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.07 65.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.47 111.423 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.0 p -62.49 -34.86 77.7 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 111.831 0.308 . . . . 1.34 111.831 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.646 HG23 ' HB2' ' A' ' 152' ' ' ALA . 2.7 m -84.49 -24.15 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.674 0.749 . . . . 0.65 109.286 -178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -62.75 -42.77 99.83 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.126 -0.943 . . . . 1.72 111.28 174.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.578 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.8 mt-10 -69.1 -36.87 78.02 Favored 'General case' 0 C--O 1.221 -0.399 0 C-N-CA 119.985 -0.686 . . . . 2.27 110.975 -178.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.614 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -66.12 -27.53 41.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 C-N-CA 120.103 -0.639 . . . . 0.81 109.844 177.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.489 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.0 mt -74.59 -37.81 62.79 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 109.693 -0.484 . . . . 1.21 109.693 172.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -57.83 -42.71 84.92 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 121.232 0.539 . . . . 0.95 109.678 178.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.578 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.2 mm? -69.25 -49.79 53.03 Favored 'General case' 0 N--CA 1.436 -1.166 0 CA-C-N 115.343 -0.844 . . . . 1.06 111.347 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 49.1 t80 -73.47 -29.36 62.47 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 118.907 -1.117 . . . . 1.54 111.665 -169.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -70.4 -38.92 74.72 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.588 -0.523 . . . . 1.98 109.588 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -92.15 68.85 5.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.514 0.673 . . . . 0.7 110.985 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.56 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 41.8 mtm -147.77 152.4 37.66 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.978 -1.01 . . . . 0.5 109.325 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.4 m -66.55 140.36 57.97 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.293 -0.262 . . . . 1.18 110.293 175.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -51.53 -42.14 61.56 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.401 0.519 . . . . 2.21 112.401 -168.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.46 66.86 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.958 0.355 . . . . 0.42 111.958 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -82.5 -29.76 35.25 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.89 -0.671 . . . . 0.31 111.537 178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt -71.06 -47.78 56.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.024 0.44 . . . . 1.32 110.29 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.89 -26.8 65.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.83 -0.623 . . . . 0.42 111.193 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -75.16 -31.12 60.92 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.267 -0.424 . . . . 0.55 110.258 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -61.38 -27.69 68.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.761 -0.654 . . . . 0.39 110.38 176.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -72.63 -13.31 78.03 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.066 -0.588 . . . . 0.27 113.303 -178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -87.74 -39.95 14.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.736 0.779 . . . . 2.43 109.536 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.423 ' HB2' HD13 ' A' ' 77' ' ' LEU . 2.0 mp0 -87.37 -36.11 17.97 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.662 -1.154 . . . . 1.83 111.539 -177.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -128.78 71.67 81.3 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 120.797 0.332 . . . . 0.69 110.693 176.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_exo -61.46 -40.51 47.49 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.906 2.404 . . . . 0.63 112.32 -176.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 60.5 t80 -62.46 -41.67 98.92 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 2.31 111.276 -177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 85.4 mt -76.02 -42.13 48.89 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.639 -0.424 . . . . 1.02 110.383 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.27 -36.51 73.36 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.23 0.538 . . . . 0.35 110.05 176.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.6 tttt -49.63 -71.67 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.158 -0.928 . . . . 2.58 111.481 171.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.5 m -64.3 -25.85 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-N 115.406 -0.815 . . . . 0.5 112.559 -171.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -71.27 -49.71 40.18 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 119.716 -0.794 . . . . 0.62 110.132 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -73.99 -34.3 64.14 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.298 -0.41 . . . . 2.58 111.2 -176.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.5 t -66.03 -19.54 65.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.223 -0.444 . . . . 1.32 110.502 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 94.48 4.79 62.15 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.59 -0.814 . . . . 1.09 112.232 178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.458 ' HG3' HD21 ' A' ' 13' ' ' LEU . 17.0 tptm -64.9 -51.07 63.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.813 0.339 . . . . 1.98 110.303 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.39 -40.39 81.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.01 0.433 . . . . 0.34 110.223 177.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.489 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -56.91 -43.99 81.92 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.673 -0.694 . . . . 0.51 111.554 178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -72.94 -25.47 61.05 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.259 -0.428 . . . . 2.82 111.504 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -74.36 -35.54 63.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.049 0.452 . . . . 0.49 110.073 176.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.646 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -81.39 -37.09 28.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.895 -0.593 . . . . 0.59 112.017 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 97.39 27.41 9.24 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 110.297 -1.121 . . . . 1.62 110.297 -169.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 68.17 170.58 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.718 0.807 . . . . 4.12 111.805 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.546 -0.74 . . . . 4.01 109.62 177.139 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 121.002 0.429 . . . . 23.59 110.211 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -108.14 81.59 0.29 Allowed Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.734 -0.746 . . . . 22.47 112.063 -179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 48.8 m -76.06 75.67 2.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.094 0.474 . . . . 21.51 110.37 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 33.0 t -75.06 106.15 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.866 -0.607 . . . . 20.19 110.479 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -95.24 23.62 5.65 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.821 -0.627 . . . . 21.42 109.46 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 63.6 m80 -134.8 26.9 3.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.28 -0.873 . . . . 18.2 109.73 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -84.29 96.96 9.18 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.67 -0.695 . . . . 16.06 110.447 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -158.29 146.29 18.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.082 -0.508 . . . . 13.27 109.789 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 65.8 m80 -118.45 163.62 16.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.446 -0.343 . . . . 12.33 110.379 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -131.56 150.67 52.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.516 -0.311 . . . . 11.33 110.713 -178.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 23.3 p -104.8 129.18 53.12 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.991 -0.55 . . . . 7.95 110.011 175.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 21.4 m -85.75 -16.44 38.9 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.0 0.429 . . . . 7.36 110.573 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 79.56 -60.98 4.29 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.876 -0.602 . . . . 4.57 112.187 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 34.8 m80 -84.46 45.34 1.12 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.945 0.403 . . . . 4.52 110.646 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 30' ' ' LYS . 54.9 tpp -160.94 119.01 2.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.984 -0.553 . . . . 2.0 110.127 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -81.53 146.15 30.32 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.288 -0.414 . . . . 1.47 110.178 -179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.403 ' HA ' ' NZ ' ' A' ' 30' ' ' LYS . 97.9 mttt -121.39 161.59 21.86 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.324 -0.235 . . . . 3.15 110.396 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -54.22 -52.6 60.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 2.35 111.598 -174.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.492 ' HA ' ' NH1' ' A' ' 11' ' ' ARG . 68.4 mm-40 -73.88 -0.13 15.08 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.621 0.6 . . . . 4.16 112.621 -177.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -91.99 -20.47 21.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.198 0.523 . . . . 2.57 110.407 -178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.35 138.69 74.89 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.556 -0.905 . . . . 0.69 108.556 176.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -45.31 112.96 0.44 Allowed 'Trans proline' 0 C--N 1.356 0.922 0 C-N-CA 123.15 2.567 . . . . 0.6 112.697 -179.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.64 -25.02 67.17 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.732 -0.667 . . . . 0.57 111.471 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -65.25 -35.33 80.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 122.238 1.018 . . . . 1.37 109.283 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.415 ' HE1' ' CG1' ' A' ' 114' ' ' VAL . 84.8 t80 -83.92 -28.43 27.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.119 -1.4 . . . . 0.8 110.617 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.492 ' NH1' ' HA ' ' A' ' 4' ' ' GLU . 53.1 mtp180 -70.0 -18.73 63.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.556 0.693 . . . . 1.73 109.732 177.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.13 -21.18 63.12 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.62 -1.173 . . . . 1.02 110.206 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.3 mt -94.05 -26.44 16.77 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.925 -0.58 . . . . 0.93 110.636 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 57.8 mtt -62.22 124.93 84.31 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.991 -0.549 . . . . 1.15 110.462 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.38 151.27 65.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.226 1.951 . . . . 0.9 112.529 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.405 ' HD3' ' CD2' ' A' ' 138' ' ' PHE . 88.0 Cg_exo -48.89 -50.09 13.5 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 122.851 2.367 . . . . 0.96 112.197 -177.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -77.21 42.62 0.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.924 -1.035 . . . . 1.83 111.355 -178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -156.79 -38.65 0.08 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.022 -0.99 . . . . 0.82 108.596 175.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -67.03 -32.09 73.07 Favored 'General case' 0 C--O 1.222 -0.366 0 CA-C-N 115.34 -0.845 . . . . 2.16 110.289 173.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -50.29 -46.91 55.57 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 123.766 0.666 . . . . 1.06 111.477 179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 43.1 t80 -58.43 -61.47 2.56 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 119.175 -0.44 . . . . 0.65 111.589 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.52 HD21 ' HE1' ' A' ' 100' ' ' TYR . 32.2 mt -73.33 -9.4 58.66 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 119.614 1.097 . . . . 1.13 112.254 -179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -68.61 -40.23 80.51 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.683 -0.488 . . . . 2.06 109.683 163.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -72.34 -54.1 10.44 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.628 -0.714 . . . . 1.84 110.881 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.6 mm? -53.94 126.58 22.95 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.434 0.635 . . . . 1.05 110.461 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -112.39 -73.59 0.66 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.027 -0.988 . . . . 1.78 111.17 -170.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.413 ' CG ' ' H ' ' A' ' 28' ' ' GLY . 3.4 p-10 -140.03 -86.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.587 0.217 . . . . 2.39 111.587 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.413 ' H ' ' CG ' ' A' ' 27' ' ' ASP . . . -63.01 -14.17 51.7 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 121.475 -0.393 . . . . 0.93 112.708 -178.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.0 OUTLIER -65.93 -38.07 87.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.286 0.565 . . . . 2.25 109.802 176.728 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.449 ' HB2' ' SD ' ' A' ' 0' ' ' MET . 76.5 mttt -77.26 -9.31 58.72 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.443 0.64 . . . . 1.31 110.732 -176.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.42 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 91.3 m -63.78 -45.81 88.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.32 -0.854 . . . . 0.8 109.801 172.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.598 HG12 ' O ' ' A' ' 29' ' ' ASP . 1.8 p -75.97 -32.77 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.933 0 CA-C-N 114.837 -1.074 . . . . 0.85 110.406 -173.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.584 HD13 HD21 ' A' ' 52' ' ' LEU . 4.5 mm? -53.55 -52.92 58.16 Favored 'General case' 0 CA--C 1.527 0.065 0 CA-C-N 116.245 -0.434 . . . . 0.98 111.443 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 7.7 ptpp? -66.78 -23.68 66.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.553 -0.294 . . . . 2.41 111.573 -175.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.9 mm-40 -72.53 -31.09 65.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.578 0.228 . . . . 1.96 110.796 176.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.8 t -74.06 -53.06 18.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.966 0.888 . . . . 0.98 109.758 174.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.3 m-85 -56.47 -42.13 77.71 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 114.628 1.344 . . . . 0.83 114.628 178.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 34' ' ' LYS . 9.5 mtmp? -79.94 7.53 8.72 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.129 -0.628 . . . . 2.18 111.197 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -103.1 -77.18 0.57 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.513 -0.767 . . . . 1.56 109.531 170.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 48.55 -157.48 1.03 Allowed Glycine 0 CA--C 1.523 0.566 0 C-N-CA 120.902 -0.666 . . . . 1.54 112.964 -174.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.412 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 11.7 Cg_endo -91.31 139.69 10.64 Favored 'Cis proline' 0 N--CA 1.455 -0.76 0 C-N-CA 124.287 -1.13 . . . . 1.68 111.288 -8.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 44.8 m-85 -110.07 112.24 24.11 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.5 0.667 . . . . 1.28 111.281 -173.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -72.71 -14.28 61.53 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.529 -1.214 . . . . 3.51 111.808 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.462 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.6 p30 -145.19 151.78 38.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.814 0.34 . . . . 1.52 111.524 -173.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.7 m -77.97 64.38 3.17 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.919 0.866 . . . . 1.18 110.122 175.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.462 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 28.0 tt0 -156.72 -43.54 0.07 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.9 -1.045 . . . . 2.24 108.724 177.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.419 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 11.7 mm-40 -59.0 -38.89 80.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.416 -0.811 . . . . 2.26 111.012 174.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 m -65.28 -39.56 92.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.295 0.569 . . . . 1.19 110.02 175.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.0 -42.1 91.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.298 -0.865 . . . . 0.55 110.335 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.37 -49.62 73.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.788 -1.097 . . . . 0.57 111.307 175.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.29 -39.97 88.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.431 0.634 . . . . 0.5 110.294 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.584 HD21 HD13 ' A' ' 33' ' ' LEU . 36.6 mt -65.49 -41.53 93.16 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.16 -0.927 . . . . 0.45 111.053 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.35 -38.22 83.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.898 0.38 . . . . 1.22 111.072 178.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -68.38 -40.86 81.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.599 -0.728 . . . . 3.05 111.387 -179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HD2' HG22 ' A' ' 32' ' ' VAL . 39.3 mttm -81.29 -49.99 10.07 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.862 0.363 . . . . 1.48 111.533 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -138.68 99.58 8.46 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.339 -0.615 . . . . 1.16 109.339 -177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -46.3 -52.28 7.48 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.992 3.128 . . . . 0.58 112.991 -176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -63.87 -34.56 78.22 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 114.94 -1.027 . . . . 2.45 112.233 -178.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.8 mt -74.89 -39.67 61.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 119.103 -1.039 . . . . 1.42 109.774 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.03 -39.0 96.08 Favored Glycine 0 N--CA 1.446 -0.655 0 CA-C-N 114.76 -1.109 . . . . 0.37 111.549 175.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.28 -39.3 89.3 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.125 -0.324 . . . . 0.48 110.125 174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 6.8 tppt? -56.58 -57.38 12.63 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.581 -0.736 . . . . 2.17 110.761 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -65.74 -30.56 50.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 1.12 111.043 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.406 ' O ' ' HD2' ' A' ' 67' ' ' HIS . 41.7 tt0 -63.99 -60.46 3.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.399 -0.364 . . . . 1.7 110.964 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.49 ' HD2' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -62.39 -32.58 73.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.593 0.711 . . . . 3.96 110.213 -174.602 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.533 ' O ' HG23 ' A' ' 70' ' ' VAL . 8.4 tp -67.84 -45.57 74.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.993 -1.003 . . . . 1.5 111.818 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.406 ' HD2' ' O ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -79.99 -18.99 48.85 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.062 -0.718 . . . . 2.34 109.062 -175.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.99 85.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.004 -0.998 . . . . 0.4 110.521 173.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.49 ' O ' ' HE2' ' A' ' 73' ' ' LYS . 30.8 mtm -59.47 -45.58 91.24 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-O 121.443 0.639 . . . . 0.72 109.629 175.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 66' ' ' LEU . 60.8 t -56.04 -40.11 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.028 -0.987 . . . . 0.79 110.548 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.9 mtpt -67.27 -31.71 72.22 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.844 -0.616 . . . . 1.47 111.83 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 45.6 m -55.35 -41.93 73.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.009 0.433 . . . . 1.26 110.713 179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 69' ' ' MET . 3.0 mmtt -71.06 -43.59 67.5 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 1.54 110.182 178.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 74.1 mt -70.63 -21.14 22.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.4 0.619 . . . . 0.34 110.898 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -79.26 -32.74 43.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.744 0.783 . . . . 0.35 109.547 178.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 0.26 57.15 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.538 -1.21 . . . . 0.49 110.324 179.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 77' ' ' LEU . 9.1 tp -93.07 133.04 36.63 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.71 109.818 -175.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.16 158.86 50.35 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.998 -0.62 . . . . 0.76 111.852 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -47.71 -34.99 22.38 Favored 'Trans proline' 0 N--CA 1.474 0.359 0 C-N-CA 123.611 2.874 . . . . 1.56 113.798 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -65.33 -55.0 20.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.06 0.457 . . . . 2.52 110.187 -178.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.3 -29.54 38.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.628 -0.714 . . . . 0.36 111.168 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 41.8 ttmt -56.5 -45.9 80.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.963 -0.562 . . . . 2.04 111.017 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.4 -42.07 98.79 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.792 -0.718 . . . . 0.41 111.928 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 16.9 t80 -66.06 -44.62 84.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.196 . . . . 1.65 111.12 177.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.28 -46.1 79.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.389 -0.369 . . . . 0.41 111.403 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 26.1 mt-10 -72.35 -35.31 68.51 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.813 -0.355 . . . . 1.96 110.744 -178.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -66.52 -50.31 63.64 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.238 -0.437 . . . . 2.12 110.402 179.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 40.5 p -67.14 -38.92 86.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.991 -0.55 . . . . 0.57 111.485 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.1 mp -57.23 -39.72 69.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.334 -0.394 . . . . 1.09 111.205 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 63.6 mt-10 -72.31 -30.61 64.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.694 0.283 . . . . 2.82 111.064 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 68.2 mt -74.59 -55.42 12.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.75 0.31 . . . . 0.51 110.614 -179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.2 -50.24 72.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.944 -0.571 . . . . 0.64 111.22 -178.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 60.9 mtt-85 -71.99 -12.96 61.48 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.944 -0.571 . . . . 4.42 110.971 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -77.73 -28.89 56.22 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.446 -0.662 . . . . 0.66 111.446 174.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 28.5 mm -62.7 -49.89 81.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.031 0.443 . . . . 0.55 110.628 176.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 0.1 OUTLIER -83.1 4.08 27.9 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.258 -0.428 . . . . 2.7 110.611 177.674 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.701 ' HA ' ' CD2' ' A' ' 100' ' ' TYR . . . -89.08 -33.95 16.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.175 -0.466 . . . . 0.63 110.03 172.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.415 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 5.7 ptp180 -86.85 5.46 36.64 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.407 -0.59 . . . . 3.1 109.407 174.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -85.33 -37.72 19.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.304 -0.862 . . . . 0.97 109.323 163.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.701 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 26.8 m-85 -57.36 -40.89 79.03 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.273 0.559 . . . . 1.48 111.201 -176.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 18.0 p -66.39 -8.31 24.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.055 -0.975 . . . . 0.87 112.687 -172.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 96.57 2.49 60.04 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.665 -0.778 . . . . 1.16 111.265 -174.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -95.43 171.01 8.96 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.356 -0.609 . . . . 1.83 109.356 177.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -138.66 110.07 8.02 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 116.627 -0.26 . . . . 1.75 110.873 -178.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.415 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 19.5 Cg_endo -61.72 143.22 96.15 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.284 1.989 . . . . 0.53 111.002 173.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.456 ' O ' HD13 ' A' ' 110' ' ' LEU . 48.3 p -75.97 165.27 25.22 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.669 -0.493 . . . . 1.48 109.669 178.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -64.18 -22.39 66.92 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.861 -0.736 . . . . 2.88 109.972 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.418 ' HA ' ' HD3' ' A' ' 111' ' ' LYS . 38.2 m-20 -72.83 -35.68 67.33 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 116.23 -0.441 . . . . 2.24 110.365 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -60.51 -42.3 96.11 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.253 -0.647 . . . . 1.73 109.253 173.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 106' ' ' THR . 7.1 mp -65.23 -46.73 79.43 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 114.987 -1.006 . . . . 0.82 110.704 176.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 108' ' ' ASP . 50.1 mtpt -55.47 -48.24 74.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.347 -0.388 . . . . 1.74 110.558 177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.431 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -62.37 -42.38 99.36 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.47 111.455 179.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.497 ' O ' HG13 ' A' ' 117' ' ' VAL . 81.1 p -62.02 -38.59 89.25 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.312 0.486 . . . . 1.34 112.312 -176.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.566 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.7 m -83.21 -23.39 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 CA-C-O 122.031 0.92 . . . . 0.65 109.454 -177.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' HB1' ' A' ' 152' ' ' ALA . 36.8 ttpt -68.44 -48.74 63.78 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.451 -1.249 . . . . 1.72 111.185 178.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.54 ' O ' HD23 ' A' ' 120' ' ' LEU . 7.8 mm-40 -65.21 -35.91 82.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.317 -0.401 . . . . 2.27 110.829 -177.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.566 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -68.12 -26.86 35.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 C-N-CA 120.662 -0.415 . . . . 0.81 110.269 175.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.546 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 73.8 mt -73.44 -37.73 65.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.537 -0.542 . . . . 1.21 109.537 171.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.5 ttpt -57.11 -46.41 82.64 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 109.197 -0.668 . . . . 0.95 109.197 178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.3 mm? -63.21 -55.36 25.67 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 115.496 -0.774 . . . . 1.06 111.68 170.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 17.5 t80 -67.86 -36.04 79.6 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 119.626 -0.83 . . . . 1.54 111.936 -166.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -64.11 -25.07 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.668 0.271 . . . . 1.98 111.464 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -93.45 -5.14 49.92 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.633 0.605 . . . . 0.7 112.633 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.473 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 51.5 mtm -74.7 157.39 35.37 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.1 -0.64 . . . . 0.5 111.21 -178.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 3.6 m -59.78 151.79 24.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.167 -0.469 . . . . 1.18 110.134 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -61.38 -40.71 95.33 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.726 -0.389 . . . . 2.21 110.757 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.35 -32.96 74.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.899 0.381 . . . . 0.42 110.683 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.66 -36.84 67.46 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.925 -0.655 . . . . 0.31 111.558 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' A' ' 124' ' ' MET . 96.6 mttt -66.08 -43.95 85.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.13 0.49 . . . . 1.32 110.391 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -66.4 -35.92 81.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.42 111.346 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.481 ' OD1' ' HD2' ' A' ' 134' ' ' LYS . 35.9 t70 -74.71 -27.97 60.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.268 0.556 . . . . 0.55 110.069 -176.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -64.79 -30.63 71.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.078 -0.51 . . . . 0.39 110.158 171.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.453 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -70.21 -26.02 74.82 Favored Glycine 0 N--CA 1.452 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.27 113.929 -175.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.481 ' HD2' ' OD1' ' A' ' 131' ' ' ASP . 15.1 ptpt -85.86 -32.12 21.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.256 0.55 . . . . 2.43 111.235 -178.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.448 ' HA ' ' NE2' ' A' ' 135' ' ' GLN . 6.7 mm100 -88.17 -41.78 12.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.676 -0.693 . . . . 1.83 110.658 -178.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -124.37 75.63 61.51 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-O 120.876 0.369 . . . . 0.69 110.465 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -62.68 -41.73 29.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.166 2.578 . . . . 0.63 112.713 -174.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.497 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 46.2 t80 -58.29 -44.8 88.67 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.151 -0.477 . . . . 2.31 111.1 -177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.6 mt -75.79 -42.27 50.6 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.422 -0.353 . . . . 1.02 110.878 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.453 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.63 -40.75 84.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.35 109.94 177.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.497 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 85.9 tttt -46.83 -68.43 0.19 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.947 -1.024 . . . . 2.58 111.26 172.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.429 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.0 m -62.83 -28.55 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.646 -0.706 . . . . 0.5 112.637 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -73.09 -49.75 26.75 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.017 -0.673 . . . . 0.62 110.633 -179.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -72.4 -32.54 66.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.596 -0.275 . . . . 2.58 111.463 -175.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.4 t -71.4 -26.68 62.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.198 0.523 . . . . 1.32 110.52 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 98.05 7.02 56.66 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.604 -0.808 . . . . 1.09 112.226 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -63.35 -48.95 75.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.911 0.386 . . . . 1.98 110.554 -179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.0 -34.97 71.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.08 0.467 . . . . 0.34 110.091 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.546 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -58.58 -54.25 49.15 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.57 -0.741 . . . . 0.51 110.466 177.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.34 -41.76 63.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 2.82 111.374 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -55.7 -46.2 77.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.841 -0.618 . . . . 0.49 111.269 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.511 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.17 -10.0 55.55 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.925 0.713 . . . . 0.59 112.925 -176.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 83.95 28.04 35.8 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.15 -1.024 . . . . 1.62 110.845 -172.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 20.7 tt0 71.66 175.36 0.29 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.064 0.946 . . . . 4.12 110.46 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.433 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 48.1 t30 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.644 -0.693 . . . . 4.01 110.068 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 15.6 tpt . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 120.778 0.323 . . . . 23.59 110.146 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 133.24 144.92 5.29 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.794 -0.717 . . . . 22.47 111.845 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 16.9 m -119.22 -5.27 10.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.733 0.301 . . . . 21.51 110.999 -178.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 14.8 m -85.09 47.78 1.46 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.527 -0.306 . . . . 20.19 111.553 -174.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -160.47 23.49 0.15 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.01 0.433 . . . . 21.42 111.365 178.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -118.99 63.59 0.78 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.511 0.672 . . . . 18.2 109.24 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -138.9 121.32 16.07 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.81 -0.632 . . . . 16.06 110.967 -178.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . 0.515 ' HA ' ' OG ' ' A' ' -3' ' ' SER . 40.5 t-80 52.18 79.61 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.617 -0.72 . . . . 13.27 112.379 170.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 47.2 m170 -113.86 -84.8 0.6 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.958 -0.297 . . . . 12.33 111.147 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -143.79 14.49 1.73 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.897 0.38 . . . . 11.33 111.247 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.6 m -131.2 29.89 4.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.23 -0.441 . . . . 7.95 110.152 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . 0.515 ' OG ' ' HA ' ' A' ' -7' ' ' HIS . 15.4 m -85.76 -178.71 6.69 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.907 -0.588 . . . . 7.36 110.455 -178.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 94.93 40.17 4.41 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 111.037 -0.825 . . . . 4.57 111.037 -175.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -84.47 -43.88 14.17 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.794 0.33 . . . . 4.52 110.62 -177.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -151.79 104.4 3.02 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.148 -0.478 . . . . 2.0 110.045 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.742 ' HA ' ' OE1' ' A' ' 4' ' ' GLU . 50.9 t80 -49.34 110.11 0.34 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.117 -0.947 . . . . 1.47 111.514 179.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -102.57 38.67 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.685 -0.688 . . . . 3.15 109.527 178.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.637 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 0.4 OUTLIER 58.09 22.2 8.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.04 -1.467 . . . . 2.35 107.04 -159.117 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.742 ' OE1' ' HA ' ' A' ' 1' ' ' PHE . 12.0 mm-40 40.92 28.48 0.05 Allowed 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 112.623 -2.08 . . . . 4.16 115.076 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.0 t0 43.08 34.19 0.62 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.209 0.528 . . . . 2.57 110.733 -175.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 3' ' ' TYR . 99.7 mt -53.29 134.44 51.57 Favored Pre-proline 0 C--O 1.232 0.141 0 CA-C-N 115.887 -0.597 . . . . 0.69 111.405 -174.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -36.23 113.06 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.035 3.157 . . . . 0.6 112.694 177.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.07 -15.82 57.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.56 -0.746 . . . . 0.57 111.227 -176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.97 -34.41 77.7 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 122.243 1.02 . . . . 1.37 108.903 178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -88.81 -33.09 17.54 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 113.58 -1.646 . . . . 0.8 111.122 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.438 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 32.3 mtm180 -68.61 -27.79 66.34 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.25 -0.648 . . . . 1.73 109.25 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -59.39 -36.15 75.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.16 -0.927 . . . . 1.02 110.594 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.66 -36.06 60.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.627 -0.715 . . . . 0.93 110.356 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 71.5 mtm -67.74 133.53 92.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.872 -0.603 . . . . 1.15 111.41 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.45 ' HB2' ' OE2' ' A' ' 17' ' ' GLU . 72.2 Cg_endo -76.99 163.83 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.577 2.185 . . . . 0.9 112.075 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.59 -44.23 17.49 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 123.085 2.523 . . . . 0.96 113.229 -179.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HA ' HD11 ' A' ' 66' ' ' LEU . 2.1 pm0 -71.79 9.23 0.94 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.752 0.649 . . . . 1.83 112.752 -176.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -125.06 -21.76 4.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.913 0.387 . . . . 0.82 110.736 172.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 63.9 mtp180 -91.89 -44.48 8.89 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.043 -0.526 . . . . 2.16 110.625 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 13.3 t70 -50.15 -50.9 47.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.544 -0.753 . . . . 1.06 111.253 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.559 ' O ' HD23 ' A' ' 25' ' ' LEU . 41.1 t80 -52.56 -62.14 1.83 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.65 111.799 178.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 1' ' ' PHE . 13.0 mt -74.59 -6.95 51.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 118.667 0.667 . . . . 1.13 111.05 -175.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.44 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 8.3 tp-100 -75.36 -43.27 51.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.17 0.51 . . . . 2.06 110.739 163.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -64.97 -47.63 76.9 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.583 -0.735 . . . . 1.84 111.842 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.559 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.7 mm? -53.34 132.72 39.72 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.48 0.657 . . . . 1.05 110.435 177.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.4 p -114.1 -72.23 0.71 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.984 -1.007 . . . . 1.78 112.083 -173.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -140.11 -82.95 0.25 Allowed 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.624 -0.43 . . . . 2.39 111.802 -178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -60.81 -29.89 71.47 Favored Glycine 0 C--N 1.329 0.151 0 C-N-CA 121.464 -0.398 . . . . 0.93 113.395 -174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -74.43 -6.83 50.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.812 0.339 . . . . 2.25 111.12 -178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.545 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 92.4 mttt -89.48 -24.81 21.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.228 0.537 . . . . 1.31 109.864 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.5 m -62.34 -33.68 75.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.309 -0.86 . . . . 0.8 111.008 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.681 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 4.4 p -75.38 -32.11 25.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.537 -0.301 . . . . 0.85 111.713 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.425 HD12 ' CE2' ' A' ' 37' ' ' PHE . 4.0 mm? -49.88 -51.87 37.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 111.867 0.321 . . . . 0.98 111.867 177.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 63.6 pttt -64.25 -33.04 74.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.758 0.313 . . . . 2.41 110.832 -177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -65.86 -24.7 66.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.079 -0.509 . . . . 1.96 110.735 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 42.5 t -91.98 -44.43 14.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.992 -0.549 . . . . 0.98 110.587 178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.425 ' CE2' HD12 ' A' ' 33' ' ' LEU . 18.9 m-85 -55.14 -34.49 63.81 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.748 0.647 . . . . 0.83 112.748 173.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -93.15 7.64 43.42 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.087 -0.645 . . . . 2.18 110.921 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.57 12.23 22.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.975 -0.557 . . . . 1.56 110.375 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.85 -158.48 19.44 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.88 -0.676 . . . . 1.54 112.181 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -77.64 163.58 87.93 Favored 'Cis proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.935 -1.277 . . . . 1.68 112.754 0.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.571 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 45.9 m-85 -121.57 134.78 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.186 -0.915 . . . . 1.28 109.599 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.6 mtmm -81.02 -12.02 59.44 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.872 -0.604 . . . . 3.51 110.482 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.597 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -161.0 165.03 30.54 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.703 -0.681 . . . . 1.52 110.191 -178.415 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 45.9 m -64.62 -29.59 70.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.222 0.326 . . . . 1.18 111.09 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -53.1 -43.85 67.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.086 -0.506 . . . . 2.24 111.402 -178.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.597 ' HG3' HD21 ' A' ' 44' ' ' ASN . 29.5 mt-10 -59.43 -42.11 91.09 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.201 -0.454 . . . . 2.26 111.215 177.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.6 t -66.32 -39.62 89.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.32 -0.4 . . . . 1.19 110.158 -179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.81 -41.98 93.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.233 0.54 . . . . 0.55 110.19 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.9 -50.09 74.81 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.164 -0.926 . . . . 0.57 111.286 177.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.94 -39.58 74.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.989 -0.551 . . . . 0.5 110.771 178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 29.9 mt -69.24 -40.23 78.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.636 -0.711 . . . . 0.45 111.03 177.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 55.4 mttm -63.38 -31.16 72.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.774 0.321 . . . . 1.22 111.779 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -71.82 -38.16 70.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.176 -0.465 . . . . 3.05 111.061 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.681 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 5.2 tppt? -85.8 -56.02 3.69 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.994 0.426 . . . . 1.48 110.835 178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.9 m -127.57 90.72 47.63 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.854 -0.612 . . . . 1.16 109.515 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -45.66 -55.41 3.58 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 124.31 3.34 . . . . 0.58 113.196 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -63.54 -32.96 74.57 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 114.603 -1.18 . . . . 2.45 112.084 -178.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.7 -39.63 66.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.049 0.928 . . . . 1.42 108.759 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -63.04 -33.82 88.3 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.124 -1.398 . . . . 0.37 111.436 175.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.32 -32.24 72.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.817 0.341 . . . . 0.48 110.662 175.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -66.96 -51.87 49.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 2.17 110.908 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.9 p -69.94 -24.23 26.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 120.851 0.358 . . . . 1.12 110.684 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -65.1 -59.29 4.28 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-N 116.257 -0.429 . . . . 1.7 110.792 177.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.47 -34.84 77.63 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.534 0.683 . . . . 3.96 109.444 -176.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 17' ' ' GLU . 18.0 tp -67.62 -30.35 69.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.691 -1.14 . . . . 1.5 110.657 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -83.58 -37.0 23.51 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 109.083 -0.71 . . . . 2.34 109.083 -177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.92 83.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.039 -0.982 . . . . 0.4 110.354 174.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.412 ' HE2' ' HB3' ' A' ' 17' ' ' GLU . 31.9 mtp -53.6 -57.96 8.88 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.354 0.597 . . . . 0.72 110.363 173.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 66' ' ' LEU . 82.9 t -56.07 -44.85 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 114.794 -1.094 . . . . 0.79 110.881 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -64.63 -42.44 95.47 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 116.053 -0.522 . . . . 1.47 111.698 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.9 m -59.21 -35.26 73.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.168 0.509 . . . . 1.26 110.89 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 88.7 mttt -78.1 -46.7 20.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.729 -0.669 . . . . 1.54 110.552 178.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.2 mt -66.25 -17.22 22.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-O 121.844 0.83 . . . . 0.34 110.379 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.16 -34.72 56.36 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.986 -1.006 . . . . 0.35 110.035 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -85.35 -1.32 56.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.811 -1.086 . . . . 0.49 110.17 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 132' ' ' PHE . 7.8 tp -96.57 138.64 33.84 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.544 -0.753 . . . . 0.71 110.417 -175.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.56 152.8 52.44 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.934 178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -41.15 -44.99 5.42 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 124.392 3.395 . . . . 1.56 114.368 -176.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.52 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 1.0 OUTLIER -69.19 -44.31 72.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.561 -0.29 . . . . 2.52 111.239 -175.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.436 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -77.29 -32.52 55.49 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.553 0.692 . . . . 0.36 109.817 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -52.33 -51.62 57.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.373 -1.285 . . . . 2.04 111.651 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.84 -40.8 95.62 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 121.014 -0.612 . . . . 0.41 112.363 -177.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 14.6 t80 -68.98 -44.1 73.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.391 0.139 . . . . 1.65 110.883 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.436 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -58.05 -37.33 74.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.977 0.418 . . . . 0.41 111.046 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.508 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 44.2 mt-10 -68.14 -48.33 65.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.059 -0.519 . . . . 1.96 110.279 178.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.429 ' O ' HG13 ' A' ' 91' ' ' ILE . 47.2 mttm -66.05 -44.19 85.31 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.346 0.498 . . . . 2.12 112.346 -178.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.404 ' HA ' HG12 ' A' ' 117' ' ' VAL . 11.8 p -59.79 -45.85 91.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.86 0.362 . . . . 0.57 110.998 -178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.436 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.6 mp -60.36 -41.88 88.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.013 -0.539 . . . . 1.09 110.648 176.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 46.4 mt-10 -64.24 -52.83 56.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.654 0.242 . . . . 2.82 111.654 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.515 HG22 ' OG ' ' A' ' 113' ' ' SER . 70.6 mt -60.51 -43.85 95.24 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-O 120.868 0.366 . . . . 0.51 111.279 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.4 -46.24 73.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.079 0.466 . . . . 0.64 111.17 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -68.65 -25.97 65.09 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.445 -0.343 . . . . 4.42 111.781 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -69.64 -36.3 75.7 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.852 -0.69 . . . . 0.66 112.024 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 mm -58.91 -41.32 82.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.009 0.433 . . . . 0.55 111.145 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.491 ' N ' ' HD3' ' A' ' 96' ' ' LYS . 0.1 OUTLIER -96.5 17.88 15.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.117 0.484 . . . . 2.7 110.707 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -102.22 -34.54 9.21 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.604 -0.725 . . . . 0.63 109.06 169.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.531 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 8.1 ptm180 -83.63 -3.23 57.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.656 -0.702 . . . . 3.1 109.954 174.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.511 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 0.6 OUTLIER -80.27 -40.08 27.64 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.491 -0.559 . . . . 0.97 109.491 164.396 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.413 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 2.9 m-85 -68.56 -32.44 72.36 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.605 -0.725 . . . . 1.48 111.985 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.3 p -65.46 -15.08 62.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.87 112.06 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 107.68 10.68 26.42 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 121.11 -0.567 . . . . 1.16 111.816 -177.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 87.5 m-20 -108.53 169.22 8.78 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.882 -0.414 . . . . 1.83 109.882 179.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.49 ' OE1' ' HB2' ' A' ' -3' ' ' SER . 38.7 mt-10 -133.15 104.83 12.43 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 121.19 -0.204 . . . . 1.75 111.302 177.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.8 Cg_endo -60.38 139.53 87.08 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 121.744 1.63 . . . . 0.53 110.647 171.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.449 HG22 ' OD2' ' A' ' 109' ' ' ASP . 11.4 t -83.97 176.64 8.72 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.799 -0.445 . . . . 1.48 109.799 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.6 pptp? -63.81 -25.79 68.33 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.511 -0.476 . . . . 2.88 110.644 -176.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -66.87 -35.44 80.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.903 -0.59 . . . . 2.24 110.01 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.449 ' OD2' HG22 ' A' ' 106' ' ' THR . 20.6 m-20 -63.96 -45.69 88.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.959 -0.564 . . . . 1.73 110.587 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -66.38 -43.89 84.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.197 -0.456 . . . . 0.82 110.58 178.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 23.9 ttmm -59.38 -42.95 92.87 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 116.193 -0.458 . . . . 1.74 110.426 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' A' ' 116' ' ' GLU . . . -68.01 -42.41 80.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.471 -0.332 . . . . 0.47 110.838 177.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.515 ' OG ' HG22 ' A' ' 91' ' ' ILE . 42.2 t -53.06 -50.26 64.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 1.34 111.096 178.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' A' ' 152' ' ' ALA . 3.8 m -77.97 -26.24 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-O 121.534 0.683 . . . . 0.65 109.639 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 62.9 tttm -60.44 -42.33 95.87 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.368 -0.833 . . . . 1.72 111.074 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 112' ' ' ALA . 29.8 mt-10 -73.39 -37.71 65.88 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.6 -0.44 . . . . 2.27 110.502 -177.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.73 -34.5 70.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 C-N-CA 120.502 -0.479 . . . . 0.81 110.39 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.532 HD23 ' O ' ' A' ' 114' ' ' VAL . 4.0 mm? -71.64 -35.24 70.33 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.062 -0.399 . . . . 1.21 110.225 172.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 5.7 tmmm? -59.31 -40.75 87.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.956 -0.757 . . . . 0.95 108.956 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -71.9 -53.71 12.3 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.228 -0.896 . . . . 1.06 111.792 172.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 72.2 t80 -69.53 -37.04 76.95 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 119.916 -0.714 . . . . 1.54 111.914 -165.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -68.66 -28.57 67.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.075 0.464 . . . . 1.98 110.987 178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.2 -5.32 56.54 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.705 -0.68 . . . . 0.7 112.136 -176.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 36.6 mtm -74.96 160.15 30.93 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.546 -0.461 . . . . 0.5 111.342 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.0 t -60.05 137.05 58.18 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.011 -0.737 . . . . 1.18 109.011 172.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.5 -39.51 73.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.561 -0.745 . . . . 2.21 111.691 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.59 87.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.903 0.382 . . . . 0.42 110.606 176.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -70.79 -33.78 66.33 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.639 -0.71 . . . . 0.31 111.46 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 129' ' ' LYS . 44.3 mtpt -64.96 -45.98 83.47 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.378 0.608 . . . . 1.32 109.714 176.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.54 -34.59 78.61 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.387 -0.824 . . . . 0.42 110.529 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.405 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 38.2 t70 -74.16 -33.91 63.64 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.381 -0.6 . . . . 0.55 109.381 -179.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.486 ' HA ' HD11 ' A' ' 77' ' ' LEU . 82.6 t80 -62.31 -32.39 73.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.735 -0.666 . . . . 0.39 110.343 171.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -70.39 -7.63 60.94 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.27 112.945 -179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 79.2 mttt -88.94 -43.45 11.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.361 0.601 . . . . 2.43 109.596 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.525 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.7 mp0 -86.34 -35.75 19.67 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.17 -0.923 . . . . 1.83 111.304 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -133.95 74.8 68.11 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.218 0.532 . . . . 0.69 110.441 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.92 -31.74 66.68 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 123.243 2.628 . . . . 0.63 112.926 -174.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' HG13 ' A' ' 142' ' ' VAL . 34.9 m-85 -61.88 -44.82 96.03 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.065 0.394 . . . . 2.31 112.065 -177.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.404 HD21 ' HD3' ' A' ' 15' ' ' PRO . 65.6 mt -72.27 -43.72 63.88 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.506 -0.478 . . . . 1.02 110.191 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.25 -31.51 67.48 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.481 0.657 . . . . 0.35 110.451 176.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 25.4 ttmm -61.54 -76.94 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.094 -0.957 . . . . 2.58 111.664 173.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.553 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.0 OUTLIER -63.9 -24.35 35.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 CA-C-N 115.173 -0.921 . . . . 0.5 112.636 -169.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -70.82 -41.62 71.32 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.799 -0.36 . . . . 0.62 110.47 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -81.6 -25.22 35.92 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.198 -0.455 . . . . 2.58 110.96 -178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.8 m -69.67 -8.72 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.03 0.443 . . . . 1.32 110.513 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 88.64 -4.06 85.06 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.901 -0.591 . . . . 1.09 113.099 175.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -69.12 -53.94 17.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.731 0.301 . . . . 1.98 111.193 -174.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.406 ' HB1' HD21 ' A' ' 118' ' ' LEU . . . -65.0 -39.64 93.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.409 -0.36 . . . . 0.34 110.603 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.44 -42.76 88.07 Favored 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.158 -0.474 . . . . 0.51 110.512 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -62.5 -41.7 99.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.826 0.346 . . . . 2.82 110.372 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -62.71 -34.86 78.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.942 -0.572 . . . . 0.49 110.332 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.558 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.48 -34.24 41.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.922 -0.581 . . . . 0.59 111.946 -178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 109.18 26.61 5.13 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.22 -0.752 . . . . 1.62 111.22 -174.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.56 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 29.3 tt0 67.87 174.58 0.27 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.063 0.945 . . . . 4.12 110.272 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.56 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 18.9 m120 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.708 -0.663 . . . . 4.01 109.935 -176.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 85.3 mtp . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 120.508 0.194 . . . . 23.59 110.671 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 156.97 -102.74 0.22 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.296 -0.954 . . . . 22.47 112.199 178.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 14.0 t -86.81 91.38 8.62 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.124 0.487 . . . . 21.51 110.365 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 16.5 p -121.78 29.0 7.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.562 0.696 . . . . 20.19 109.731 176.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -80.56 103.23 10.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.351 -0.841 . . . . 21.42 110.163 -176.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -56.49 -41.45 76.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.569 -0.741 . . . . 18.2 111.86 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -76.12 89.1 3.04 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.966 0.412 . . . . 16.06 110.874 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -88.9 86.06 6.87 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.232 -0.44 . . . . 13.27 110.955 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -86.25 76.42 9.71 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.835 -0.802 . . . . 12.33 108.835 174.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -85.2 95.98 9.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.793 -0.64 . . . . 11.33 110.664 -174.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 11.5 t -141.03 168.27 20.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.029 -0.532 . . . . 7.95 109.815 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.1 p -60.28 125.81 25.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.943 -0.571 . . . . 7.36 111.665 -177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 118.98 -8.23 12.67 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.863 -0.684 . . . . 4.57 112.479 178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -121.49 2.67 10.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.816 0.341 . . . . 4.52 111.318 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.435 ' HG3' ' HB2' ' A' ' 30' ' ' LYS . 21.7 ttm -158.23 91.42 1.1 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.032 -0.531 . . . . 2.0 109.991 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.467 ' CE1' ' HG3' ' A' ' 30' ' ' LYS . 18.6 p90 -65.21 156.88 30.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.839 -0.619 . . . . 1.47 111.435 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.527 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 68.5 mttm -118.09 157.0 27.67 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.745 -0.662 . . . . 3.15 109.733 176.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -66.64 -18.08 65.18 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.464 0.649 . . . . 2.35 109.736 175.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -84.24 -14.65 49.36 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.313 -0.858 . . . . 4.16 110.847 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.527 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 5.5 m-20 -93.66 -6.03 47.28 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.294 0.569 . . . . 2.57 110.414 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.1 mt -85.49 135.41 38.59 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.325 -0.852 . . . . 0.69 108.952 175.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_exo -46.24 114.26 0.81 Allowed 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 123.199 2.599 . . . . 0.6 112.583 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.27 -22.97 67.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.884 -0.598 . . . . 0.57 111.713 -176.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -63.86 -36.32 83.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.897 0.856 . . . . 1.37 109.556 179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -88.27 -19.03 27.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.097 -1.411 . . . . 0.8 110.618 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 -74.53 -25.49 59.37 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.502 0.668 . . . . 1.73 109.557 176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.604 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 27.5 t70 -67.16 -25.16 66.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.066 -0.97 . . . . 1.02 110.36 173.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.445 HD21 ' HG3' ' A' ' 147' ' ' LYS . 98.2 mt -87.3 7.68 27.64 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.929 -0.578 . . . . 0.93 111.013 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.536 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 67.1 mtt -93.79 122.06 63.09 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 116.452 -0.34 . . . . 1.15 110.143 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -66.2 150.35 84.96 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 C-N-CA 122.286 1.991 . . . . 0.9 111.159 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -45.87 -45.19 17.53 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 123.009 2.473 . . . . 0.96 113.246 -172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -57.89 -50.43 73.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.952 0.406 . . . . 1.83 111.134 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.7 -37.08 70.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.199 -0.455 . . . . 0.82 111.836 -174.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.536 ' HD2' ' O ' ' A' ' 14' ' ' MET . 14.0 ptm180 -76.91 -29.17 55.6 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 121.019 -0.273 . . . . 2.16 111.071 -177.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.49 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 27.9 t70 -56.39 -45.38 80.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.712 0.292 . . . . 1.06 110.553 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' O ' HD23 ' A' ' 25' ' ' LEU . 50.2 t80 -55.58 -60.35 3.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.07 -0.514 . . . . 0.65 111.823 177.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.499 HD21 ' CE1' ' A' ' 100' ' ' TYR . 23.1 mt -73.45 -8.11 54.55 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 119.791 1.178 . . . . 1.13 112.045 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 28.1 tt0 -69.07 -38.7 79.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.086 0.469 . . . . 2.06 109.875 163.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -72.15 -54.23 10.32 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.808 -0.633 . . . . 1.84 110.349 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.617 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -54.12 130.62 38.86 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.227 -0.897 . . . . 1.05 111.115 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 m -129.96 -82.34 0.55 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.508 -0.769 . . . . 1.78 110.994 -173.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -144.54 154.59 43.03 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.546 -0.538 . . . . 2.39 109.546 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -45.76 3.52 Favored Glycine 0 C--N 1.322 -0.225 0 C-N-CA 120.462 -0.875 . . . . 0.93 111.694 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.51 -29.74 69.23 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.534 -0.543 . . . . 2.25 109.534 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HE3' ' HB3' ' A' ' 25' ' ' LEU . 1.5 mptm? -62.44 -18.07 60.85 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.008 -0.542 . . . . 1.31 110.361 176.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 37.4 m -74.4 -45.48 46.45 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.757 -0.656 . . . . 0.8 110.318 174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.77 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 2.3 p -73.17 -41.77 58.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 C-N-CA 120.281 -0.567 . . . . 0.85 110.917 -177.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.598 HD12 ' HE1' ' A' ' 37' ' ' PHE . 3.8 mm? -55.94 -35.57 66.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.623 0.249 . . . . 0.98 110.837 175.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 64.2 tttm -70.27 -27.49 64.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.396 -0.365 . . . . 2.41 111.243 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.26 -28.52 14.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.629 0.252 . . . . 1.96 111.676 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 39' ' ' ALA . 74.6 t -83.94 -28.12 7.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.153 0.501 . . . . 0.98 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.598 ' HE1' HD12 ' A' ' 33' ' ' LEU . 15.0 m-85 -74.39 -24.94 59.2 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 113.895 1.072 . . . . 0.83 113.895 165.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 71.7 mmtt -75.73 -17.81 59.79 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 106.815 -1.55 . . . . 2.18 106.815 165.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 36' ' ' VAL . . . 70.16 -79.19 0.04 OUTLIER 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 116.94 2.2 . . . . 1.56 116.94 154.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 177.79 -72.34 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 118.628 -1.749 . . . . 1.54 114.09 -157.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -88.36 172.28 30.9 Favored 'Cis proline' 0 N--CA 1.461 -0.438 0 N-CA-C 115.081 1.147 . . . . 1.68 115.081 7.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.546 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 15.4 m-85 -100.63 155.79 17.68 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 114.263 -1.335 . . . . 1.28 110.572 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -101.4 -12.01 18.93 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.72 -0.673 . . . . 3.51 110.707 174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.597 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -157.66 161.84 38.62 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.598 -0.274 . . . . 1.52 111.365 -177.307 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.9 m -60.03 -35.16 74.5 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 123.223 0.327 . . . . 1.18 111.287 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -49.56 -38.63 31.91 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.998 -0.547 . . . . 2.24 112.135 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.597 ' HG3' HD21 ' A' ' 44' ' ' ASN . 28.3 mt-10 -70.25 -31.13 68.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.724 -0.217 . . . . 2.26 111.434 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 t -72.72 -43.08 63.44 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.56 -0.534 . . . . 1.19 109.56 178.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 83.2 mt -64.39 -43.21 97.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.55 109.785 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.9 -48.23 78.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.413 -0.812 . . . . 0.57 111.139 173.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.69 -44.92 86.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.448 0.642 . . . . 0.5 110.463 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 63' ' ' VAL . 30.0 mt -68.76 -40.17 79.89 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-N 114.957 -1.02 . . . . 0.45 111.215 -178.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -66.32 -22.22 66.27 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.562 -0.455 . . . . 1.22 111.218 177.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.2 ttpp -84.4 -33.05 23.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.974 -0.557 . . . . 3.05 110.758 177.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.77 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 22.8 tptp -90.57 -60.77 1.83 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.886 -0.597 . . . . 1.48 110.769 -178.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.5 p -127.96 85.88 59.54 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 115.87 -0.604 . . . . 1.16 109.713 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -44.32 -60.02 0.93 Allowed 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 124.051 3.167 . . . . 0.58 113.747 -168.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -64.33 -26.06 68.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.649 -1.16 . . . . 2.45 111.608 -176.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.485 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 52.7 tp -75.19 -39.48 60.18 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.655 0.741 . . . . 1.42 109.546 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.18 -32.09 81.31 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 114.91 -1.041 . . . . 0.37 111.3 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -34.84 78.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.705 -0.247 . . . . 0.48 110.606 174.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 57.8 mttp -61.53 -45.08 95.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.086 0.47 . . . . 2.17 110.072 175.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.65 HG21 HD13 ' A' ' 52' ' ' LEU . 21.2 t -71.39 -38.51 69.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.859 -0.61 . . . . 1.12 110.763 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.06 -44.01 90.39 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.132 -0.486 . . . . 1.7 111.231 -178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -66.01 -40.55 91.21 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.079 -0.711 . . . . 3.96 109.079 179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 21' ' ' PHE . 61.5 tp -65.25 -35.25 80.47 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.284 -0.871 . . . . 1.5 110.722 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -73.64 -39.63 64.35 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.46 -0.941 . . . . 2.34 108.46 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.62 -37.63 87.14 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.892 -1.049 . . . . 0.4 110.624 176.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.414 ' SD ' ' HA ' ' A' ' 66' ' ' LEU . 21.5 mtp -61.64 -57.61 11.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.306 0.574 . . . . 0.72 110.71 176.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 66' ' ' LEU . 87.4 t -58.69 -43.7 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 115.515 -0.766 . . . . 0.79 110.708 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.6 mmmt -64.51 -34.29 77.87 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.931 -0.577 . . . . 1.47 111.563 178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 38.2 t -57.98 -48.9 78.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.084 0.469 . . . . 1.26 110.287 178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.515 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 62.2 mttm -66.16 -47.73 73.05 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.559 -0.746 . . . . 1.54 110.529 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.64 -24.51 33.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.244 0.545 . . . . 0.34 111.408 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.92 64.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.468 0.652 . . . . 0.35 110.495 174.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.39 -2.54 58.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.191 -0.913 . . . . 0.49 110.456 -178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.423 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 9.4 tp -95.45 130.51 42.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.686 -0.688 . . . . 0.71 110.041 -176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.77 152.26 46.02 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.837 -0.696 . . . . 0.76 112.11 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_exo -40.21 -43.28 3.79 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 124.243 3.295 . . . . 1.56 114.397 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -63.9 -44.63 92.39 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.886 0.374 . . . . 2.52 111.159 -176.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.423 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -86.07 -30.82 22.32 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.498 -0.481 . . . . 0.36 110.411 -177.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -57.89 -46.34 85.05 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.485 -0.779 . . . . 2.04 110.758 176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -58.28 -41.06 94.78 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.885 -0.674 . . . . 0.41 112.067 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.8 t80 -69.52 -46.38 66.66 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.981 -0.11 . . . . 1.65 110.967 176.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.93 -47.16 78.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.118 0.485 . . . . 0.41 111.267 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.629 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 48.3 mt-10 -65.73 -39.66 91.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.795 -0.638 . . . . 1.96 110.704 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -74.3 -42.11 60.05 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.516 -0.311 . . . . 2.12 111.487 -177.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.1 p -64.37 -39.36 93.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.912 0.387 . . . . 0.57 110.168 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.33 -39.92 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.773 -0.649 . . . . 1.09 110.215 173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.629 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.5 mt-10 -66.48 -45.69 78.82 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 111.465 0.172 . . . . 2.82 111.465 179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.436 HG22 ' OG ' ' A' ' 113' ' ' SER . 68.9 mt -61.97 -43.15 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.959 0.409 . . . . 0.51 110.546 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.04 -37.94 75.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.237 -0.438 . . . . 0.64 110.015 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -60.05 -43.01 95.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.794 -0.639 . . . . 4.42 110.964 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.404 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -63.74 -30.15 76.82 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 121.088 -0.577 . . . . 0.66 112.496 -177.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -68.0 -46.13 82.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.772 0.32 . . . . 0.55 111.35 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -82.4 -17.78 44.25 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.576 -0.449 . . . . 2.7 110.199 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.453 ' HA ' ' CE2' ' A' ' 37' ' ' PHE . . . -61.86 -37.9 86.26 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 120.805 0.336 . . . . 0.63 110.446 171.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.459 ' O ' ' HB2' ' A' ' 103' ' ' ASN . 11.7 ptm180 -89.92 7.81 35.42 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.086 -0.506 . . . . 3.1 110.564 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.38 -41.15 9.15 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.65 -0.871 . . . . 0.97 108.65 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.499 ' CE1' HD21 ' A' ' 22' ' ' LEU . 28.5 m-85 -61.98 -34.72 76.67 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.675 -0.693 . . . . 1.48 111.342 -178.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.3 p -73.56 1.62 9.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.209 -0.45 . . . . 0.87 112.179 -178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.432 ' HA3' ' HE2' ' A' ' 34' ' ' LYS . . . 89.16 6.41 71.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.093 -0.575 . . . . 1.16 112.356 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 80.4 m-20 -96.47 -176.8 3.74 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.049 -0.352 . . . . 1.83 110.049 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 42.7 mt-10 -147.3 109.3 3.92 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.606 -0.27 . . . . 1.75 110.997 178.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 26.2 Cg_endo -64.14 157.31 54.28 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.823 2.349 . . . . 0.53 112.162 174.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 74.4 p -81.31 171.4 14.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.753 -0.462 . . . . 1.48 109.753 177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.96 -26.37 68.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.26 -0.644 . . . . 2.88 109.26 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -67.78 -39.16 84.12 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 115.266 -0.879 . . . . 2.24 110.611 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -59.39 -41.65 89.86 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 121.177 0.513 . . . . 1.73 110.448 176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.443 ' O ' HG13 ' A' ' 114' ' ' VAL . 6.8 mp -68.96 -45.03 71.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.82 110.669 178.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 28.8 mtpp -57.63 -48.25 79.97 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.216 -0.447 . . . . 1.74 110.56 177.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.476 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -64.04 -38.77 92.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.47 110.989 178.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.508 ' O ' HG13 ' A' ' 117' ' ' VAL . 27.1 t -54.46 -49.63 69.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 1.34 111.095 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.633 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.1 m -81.44 -22.58 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.765 0.793 . . . . 0.65 109.951 -174.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 46.8 tttm -67.98 -45.68 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.784 -1.098 . . . . 1.72 111.138 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 15.1 mm-40 -70.69 -34.05 71.56 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.623 -0.431 . . . . 2.27 110.656 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.633 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.0 -31.89 55.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 C-N-CA 120.616 -0.433 . . . . 0.81 110.391 176.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 30.3 mt -73.05 -36.27 66.86 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.051 -0.352 . . . . 1.21 110.051 175.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.422 ' HD2' HD12 ' A' ' 120' ' ' LEU . 2.2 ttmm -59.5 -48.02 83.26 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 109.026 -0.731 . . . . 0.95 109.026 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -68.54 -45.51 71.96 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 114.876 -1.056 . . . . 1.06 111.768 176.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 10.4 t80 -69.52 -37.04 76.96 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.274 -0.571 . . . . 1.54 111.643 -170.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -65.16 -27.78 68.95 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 1.98 111.395 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.41 -6.86 59.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.089 -0.505 . . . . 0.7 112.055 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 42.6 mtm -76.4 153.95 35.27 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.248 -0.581 . . . . 0.5 110.382 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 19.5 m -65.8 150.25 48.85 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.64 -0.255 . . . . 1.18 110.559 174.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -54.93 -46.56 74.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.217 0.451 . . . . 2.21 112.217 -171.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.31 -32.97 70.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.81 0.338 . . . . 0.42 110.926 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.14 -34.16 55.73 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.881 -0.6 . . . . 0.31 111.788 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -64.54 -45.88 85.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.076 0.465 . . . . 1.32 110.359 176.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.59 -28.19 65.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.678 -0.692 . . . . 0.42 110.86 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.418 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 15.8 t70 -77.31 -35.34 55.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.505 -0.554 . . . . 0.55 109.505 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -60.57 -31.02 70.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.745 -0.661 . . . . 0.39 110.297 172.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.76 -5.63 69.77 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.098 -0.572 . . . . 0.27 113.248 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 77.6 mttt -94.74 -42.06 8.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.783 0.802 . . . . 2.43 109.485 178.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.515 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 1.9 mp0 -80.96 -40.28 24.72 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.769 -1.105 . . . . 1.83 110.968 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -130.87 72.88 81.63 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.052 0.453 . . . . 0.69 110.713 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -65.47 -32.48 49.38 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.957 2.438 . . . . 0.63 112.964 -176.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.48 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 44.2 t80 -60.45 -41.77 94.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.916 0.389 . . . . 2.31 110.554 -178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.41 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 97.1 mt -77.62 -42.84 33.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.245 -0.434 . . . . 1.02 110.533 -178.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.16 -34.58 72.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.058 0.456 . . . . 0.35 110.215 177.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.7 tttp -52.91 -70.85 0.08 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.223 -0.899 . . . . 2.58 111.477 171.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.485 ' HB ' ' HB3' ' A' ' 147' ' ' LYS . 3.4 m -62.5 -30.41 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 115.165 -0.925 . . . . 0.5 112.955 -172.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.41 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.6 m-30 -67.1 -47.89 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.134 -0.626 . . . . 0.62 110.216 -179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -72.19 -38.59 69.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.953 -0.567 . . . . 2.58 111.353 -176.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 31.2 t -70.77 -20.68 62.58 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 1.32 110.705 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 96.66 2.14 60.02 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.751 -0.738 . . . . 1.09 112.372 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.604 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 44.3 tptt -56.98 -46.72 82.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.829 0.347 . . . . 1.98 110.853 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -77.89 -36.94 49.05 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.141 0.496 . . . . 0.34 110.34 177.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.44 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -57.69 -46.95 83.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.533 -0.758 . . . . 0.51 111.758 -178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -65.47 -35.49 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 2.82 110.851 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -64.07 -35.37 80.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.304 0.573 . . . . 0.49 109.872 177.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.598 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -78.69 -22.88 46.03 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.662 -0.699 . . . . 0.59 111.683 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 92.48 22.61 28.66 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.277 -0.729 . . . . 1.62 111.277 -174.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -96.39 -128.47 0.15 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.221 0.534 . . . . 4.12 111.644 -175.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.1 p30 . . . . . 0 C--O 1.246 0.886 0 CA-C-N 115.265 -0.879 . . . . 4.01 111.373 -170.638 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 16.1 tpt . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.766 0.317 . . . . 23.59 110.454 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -156.38 -173.98 25.58 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.891 -0.671 . . . . 22.47 111.976 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 12.3 p -89.6 86.32 6.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.911 0.386 . . . . 21.51 110.82 -178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 30.7 t -70.98 -57.94 4.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.113 -0.494 . . . . 20.19 110.006 177.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -141.06 -66.47 0.42 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.836 -0.62 . . . . 21.42 109.868 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 35.1 t-80 -170.58 -54.27 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.705 -0.679 . . . . 18.2 110.089 179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 50.8 t60 -157.89 146.27 19.01 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.248 -0.433 . . . . 16.06 109.941 -178.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -79.85 97.84 6.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.496 -0.32 . . . . 13.27 110.34 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -85.76 -70.37 0.6 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.939 0.4 . . . . 12.33 110.734 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -82.41 -12.05 58.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.128 -0.487 . . . . 11.33 110.51 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 18.3 m 66.07 28.27 10.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.726 -0.67 . . . . 7.95 111.837 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 50.3 m -83.53 88.41 7.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.072 0.463 . . . . 7.36 110.525 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -76.1 111.29 3.26 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.898 -0.668 . . . . 4.57 111.736 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -72.3 95.64 1.74 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.986 0.422 . . . . 4.52 110.252 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 84.9 mmm -93.44 136.66 33.49 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 2.0 109.706 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -73.97 146.39 43.92 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.97 -0.559 . . . . 1.47 110.541 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' ILE . 33.6 mmtp -120.44 139.33 52.99 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.177 -0.465 . . . . 3.15 109.922 178.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -65.53 -30.32 71.06 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.409 -0.589 . . . . 2.35 109.409 175.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -74.9 -19.35 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.369 -0.832 . . . . 4.16 110.698 177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -89.96 -13.13 36.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.166 0.508 . . . . 2.57 110.0 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 2' ' ' LYS . 70.8 mt -77.52 129.78 76.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 109.079 -0.712 . . . . 0.69 109.079 175.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.84 113.66 0.51 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 123.336 2.691 . . . . 0.6 112.379 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.36 65.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.711 -0.677 . . . . 0.57 111.686 -174.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.87 -35.57 76.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.745 0.783 . . . . 1.37 110.263 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -85.56 -29.77 23.88 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 114.585 -1.189 . . . . 0.8 111.064 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -68.45 -27.05 65.84 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.196 -0.668 . . . . 1.73 109.196 -179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -60.61 -32.27 71.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.312 -1.313 . . . . 1.02 110.615 174.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 68.3 mt -80.57 -31.08 36.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.543 -0.753 . . . . 0.93 111.194 -176.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 73.7 mtm -71.21 134.83 84.89 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.014 0.435 . . . . 1.15 111.33 -176.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.4 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 44.1 Cg_endo -68.92 146.02 63.99 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 122.721 2.281 . . . . 0.9 112.265 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -43.74 -49.35 8.11 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 123.721 2.947 . . . . 0.96 113.813 -173.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.536 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.8 pm0 -57.56 -39.41 76.63 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.798 0.332 . . . . 1.83 111.811 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.05 -14.51 60.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.774 0.321 . . . . 0.82 111.072 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 19' ' ' ARG . 16.8 mtm180 -91.39 -33.71 15.16 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 2.16 110.299 178.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.05 -45.45 32.26 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.925 -0.579 . . . . 1.06 111.45 178.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.446 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 38.5 t80 -70.81 1.19 5.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.833 -0.621 . . . . 0.65 112.334 -178.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.535 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.9 mt -127.83 -16.27 4.72 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 121.569 -0.707 . . . . 1.13 111.27 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -63.51 -41.25 98.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.886 -0.783 . . . . 2.06 108.886 164.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -75.58 -51.78 12.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.142 -0.936 . . . . 1.84 112.709 -179.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.535 HD13 HD11 ' A' ' 33' ' ' LEU . 42.0 mt -58.14 142.04 48.43 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.951 0.882 . . . . 1.05 112.79 -172.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.0 p -136.35 -164.55 1.58 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 113.957 -1.474 . . . . 1.78 109.804 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -62.72 151.52 38.23 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.703 0.287 . . . . 2.39 110.432 177.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . 86.9 -45.56 3.45 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.666 -0.778 . . . . 0.93 112.374 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.618 ' O ' HG12 ' A' ' 32' ' ' VAL . 6.4 m-20 -74.67 -37.05 62.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.542 0.687 . . . . 2.25 109.733 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' HA ' HD12 ' A' ' 33' ' ' LEU . 89.0 mttt -70.33 -18.02 63.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.633 -0.712 . . . . 1.31 110.194 178.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 53.1 m -66.89 -40.85 87.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.098 -0.955 . . . . 0.8 111.003 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.618 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.3 p -79.23 -27.06 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 0.85 110.631 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.535 HD11 HD13 ' A' ' 25' ' ' LEU . 87.8 mt -56.92 -49.84 74.39 Favored 'General case' 0 CA--C 1.521 -0.146 0 N-CA-C 111.8 0.296 . . . . 0.98 111.8 177.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 31' ' ' THR . 25.0 pttm -61.09 -25.26 66.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.822 0.344 . . . . 2.41 110.884 -175.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -69.78 -35.97 75.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.02 0.438 . . . . 1.96 110.438 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.2 t -73.81 -55.89 10.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.575 0.702 . . . . 0.98 110.137 177.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HD2' ' O ' ' A' ' 33' ' ' LEU . 72.9 m-85 -58.27 -46.56 85.81 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 114.763 1.394 . . . . 0.83 114.763 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -77.98 -13.55 59.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 118.501 0.591 . . . . 2.18 111.326 -176.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -79.8 -78.33 0.16 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.325 -0.398 . . . . 1.56 109.997 170.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.402 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 45.94 -157.56 0.37 Allowed Glycine 0 CA--C 1.523 0.54 0 C-N-CA 121.01 -0.614 . . . . 1.54 113.394 -174.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.402 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.4 Cg_endo -91.47 172.69 21.91 Favored 'Cis proline' 0 N--CA 1.457 -0.663 0 C-N-CA 124.231 -1.154 . . . . 1.68 111.196 -7.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -131.49 106.53 8.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.272 0.558 . . . . 1.28 111.671 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -72.71 -18.92 61.49 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.205 -0.907 . . . . 3.51 110.026 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -145.5 157.92 43.92 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.858 -0.61 . . . . 1.52 109.61 -177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.5 m -76.13 -27.42 57.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.953 -0.567 . . . . 1.18 111.518 -174.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -58.57 -42.99 89.24 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.728 0.299 . . . . 2.24 110.842 178.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.24 -33.81 72.82 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-O 121.34 0.59 . . . . 2.26 110.896 178.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 37.8 t -74.04 -42.55 60.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 1.19 110.364 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 78.4 mt -64.32 -42.53 95.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.326 0.584 . . . . 0.55 109.886 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.34 -38.05 76.39 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.137 -0.938 . . . . 0.57 111.381 175.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -68.65 -38.08 80.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.412 0.625 . . . . 0.5 110.349 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.9 mt -72.81 -35.55 67.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.289 -0.869 . . . . 0.45 111.17 178.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -63.37 -41.81 98.82 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 121.071 -0.252 . . . . 1.22 111.656 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 ptpp? -72.71 -33.57 66.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.929 0.395 . . . . 3.05 110.791 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.436 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 29.7 mmtm -77.82 -47.67 18.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.158 -0.474 . . . . 1.48 111.716 177.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -148.62 95.51 3.98 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-O 120.688 0.28 . . . . 1.16 110.67 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_exo -41.07 -56.53 1.67 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 124.122 3.215 . . . . 0.58 113.827 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.02 -33.26 75.04 Favored 'General case' 0 C--N 1.334 -0.067 0 CA-C-N 115.193 -0.912 . . . . 2.45 112.435 -178.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -72.25 -42.36 65.72 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 108.8 -0.815 . . . . 1.42 108.8 -176.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.421 ' HA2' HG22 ' A' ' 63' ' ' VAL . . . -64.91 -33.99 88.7 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 114.051 -1.431 . . . . 0.37 111.449 174.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.09 -32.1 72.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.763 0.316 . . . . 0.48 110.895 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 26.7 mtpp -67.03 -54.92 17.05 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 116.595 -0.275 . . . . 2.17 110.337 175.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.421 HG22 ' HA2' ' A' ' 60' ' ' GLY . 25.6 m -67.61 -22.61 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.166 0 C-N-CA 120.906 -0.318 . . . . 1.12 111.188 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.75 -58.26 9.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.064 -0.516 . . . . 1.7 109.838 172.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -71.95 -32.58 67.45 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.798 -0.637 . . . . 3.96 109.969 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -62.61 -41.6 99.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.889 -1.05 . . . . 1.5 109.452 179.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 23.0 t-80 -74.3 -38.76 63.26 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.913 -0.773 . . . . 2.34 108.913 -176.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.0 -43.33 95.98 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 114.821 -1.081 . . . . 0.4 111.014 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 28.9 mtp -55.88 -55.01 37.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.097 0.475 . . . . 0.72 110.8 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.453 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 69.3 t -58.58 -44.67 89.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 CA-C-N 115.149 -0.932 . . . . 0.79 110.554 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -60.54 -37.51 81.46 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.671 -0.695 . . . . 1.47 111.512 177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 66.8 m -64.09 -37.78 88.69 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 1.26 110.859 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.682 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 95.8 mttt -72.44 -23.68 61.1 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 116.435 -0.348 . . . . 1.54 110.576 177.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.45 HG23 ' HB2' ' A' ' 82' ' ' LYS . 67.3 mt -89.15 -19.14 7.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.769 0.795 . . . . 0.34 110.159 175.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.03 -36.77 58.95 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.211 -0.904 . . . . 0.35 109.789 174.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.509 ' HB3' ' OE1' ' A' ' 135' ' ' GLN . . . -90.55 -8.01 51.39 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.722 -1.126 . . . . 0.49 109.448 -178.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.682 ' HB2' ' O ' ' A' ' 73' ' ' LYS . 4.8 tp -86.9 121.9 30.02 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 106.377 -1.712 . . . . 0.71 106.377 172.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.803 ' N ' ' HD3' ' A' ' 79' ' ' PRO . . . -99.21 -12.36 42.53 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.528 1.371 . . . . 0.76 116.528 -172.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.803 ' HD3' ' N ' ' A' ' 78' ' ' GLY . 8.6 Cg_endo -98.97 -146.31 0.02 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.089 0 CA-C-N 121.501 2.651 . . . . 1.56 116.844 -170.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -80.01 -7.07 58.63 Favored 'General case' 0 N--CA 1.439 -1.015 0 N-CA-C 106.613 -1.625 . . . . 2.52 106.613 167.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -68.88 -36.49 78.14 Favored 'General case' 0 CA--C 1.499 -0.982 0 CA-C-N 115.361 -0.836 . . . . 0.36 109.467 179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.626 ' HD2' ' O ' ' A' ' 77' ' ' LEU . 1.0 OUTLIER -72.42 -36.75 68.69 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 115.635 -0.711 . . . . 2.04 109.098 177.031 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.408 ' N ' ' HG2' ' A' ' 82' ' ' LYS . . . -64.36 -43.44 96.83 Favored Glycine 0 C--N 1.336 0.542 0 C-N-CA 120.091 -1.052 . . . . 0.41 111.623 174.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 8.8 t80 -66.06 -39.05 89.78 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 122.708 0.403 . . . . 1.65 111.063 176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -56.55 -43.03 79.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.483 0.658 . . . . 0.41 110.356 177.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 82' ' ' LYS . 7.4 mm-40 -59.46 -30.88 68.83 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.008 -0.996 . . . . 1.96 111.108 177.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -87.37 -47.01 9.14 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.435 -0.348 . . . . 2.12 111.032 -177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.428 ' HB3' ' CE1' ' A' ' 84' ' ' PHE . 10.1 p -61.11 -47.08 87.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.198 -0.455 . . . . 0.57 111.472 -175.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.7 mp -62.0 -40.11 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.27 -0.423 . . . . 1.09 110.279 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -62.8 -45.01 94.63 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.372 -0.377 . . . . 2.82 111.178 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.2 mt -65.01 -46.56 91.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.579 -0.282 . . . . 0.51 110.932 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.91 -37.73 88.46 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.299 0.571 . . . . 0.64 110.007 178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 35.6 ttt85 -59.38 -35.84 74.67 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.346 -0.843 . . . . 4.42 110.78 175.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -66.03 -35.34 90.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.018 -0.61 . . . . 0.66 112.474 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.613 HG21 HD23 ' A' ' 110' ' ' LEU . 49.1 mm -71.69 -48.22 53.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.095 0.474 . . . . 0.55 109.921 177.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -85.23 27.53 0.79 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.668 0.747 . . . . 2.7 110.258 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -117.06 -27.65 6.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.072 -0.967 . . . . 0.63 109.599 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.434 ' HG3' ' HD3' ' A' ' 105' ' ' PRO . 17.8 ptp180 -91.47 -1.03 57.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.116 -0.493 . . . . 3.1 109.997 176.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -83.65 -38.59 21.32 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.999 -0.741 . . . . 0.97 108.999 163.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.535 ' CE1' HD21 ' A' ' 22' ' ' LEU . 4.4 m-30 -67.86 -24.96 65.31 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.349 -0.841 . . . . 1.48 111.41 -173.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.5 p -77.65 -4.58 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.853 -0.612 . . . . 0.87 112.177 -177.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.79 7.83 65.97 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.415 -0.897 . . . . 1.16 111.346 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -100.55 166.0 11.14 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.865 -0.791 . . . . 1.83 108.865 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.431 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 50.2 mt-10 -134.92 110.22 10.93 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 121.028 -0.269 . . . . 1.75 111.297 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HD3' ' HG3' ' A' ' 98' ' ' ARG . 14.6 Cg_endo -61.55 151.55 79.24 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 122.416 2.078 . . . . 0.53 111.348 173.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.7 p -81.17 167.57 19.5 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.576 -0.527 . . . . 1.48 109.576 177.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.494 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 39.4 ttpt -64.24 -29.64 70.73 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.249 -0.649 . . . . 2.88 109.249 177.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -65.34 -36.28 83.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.241 -0.891 . . . . 2.24 110.896 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -60.69 -44.32 96.66 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.121 0.486 . . . . 1.73 109.985 173.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.613 HD23 HG21 ' A' ' 95' ' ' ILE . 61.7 mt -66.32 -40.31 89.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.298 -0.864 . . . . 0.82 111.411 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 94.5 mttt -60.23 -44.58 95.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.091 0.472 . . . . 1.74 110.238 176.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.549 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -62.51 -43.98 97.48 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.765 -0.652 . . . . 0.47 111.541 179.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.445 ' O ' HG13 ' A' ' 117' ' ' VAL . 5.2 p -61.77 -32.25 72.51 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.38 0.511 . . . . 1.34 112.38 -177.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.531 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.9 m -87.63 -25.74 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 CA-C-O 121.511 0.672 . . . . 0.65 110.126 -178.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.9 ptmm? -79.61 -24.62 41.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.509 -0.769 . . . . 1.72 110.937 -175.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 20.1 mm-40 -78.76 -38.95 37.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.341 -0.543 . . . . 2.27 110.438 175.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.5 m -66.36 -29.43 46.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 C-N-CA 120.611 -0.435 . . . . 0.81 110.017 176.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 44.6 mt -68.91 -40.83 78.89 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.086 -0.709 . . . . 1.21 109.086 172.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 5.4 tmmm? -54.02 -46.56 71.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.731 -0.668 . . . . 0.95 110.289 178.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.32 -46.82 81.89 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.384 -0.371 . . . . 1.06 111.342 171.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 48.3 t80 -72.54 -33.52 66.91 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 119.739 -0.784 . . . . 1.54 112.41 -167.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 10.0 mttp -63.77 -32.34 73.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 1.98 110.573 178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -86.95 -4.34 59.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.232 0.827 . . . . 0.7 113.232 -171.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 37.4 mtm -75.53 155.68 35.85 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.093 -0.643 . . . . 0.5 110.712 -178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.6 m -60.79 146.65 45.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.52 -0.309 . . . . 1.18 110.208 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.19 -47.56 75.08 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.25 0.463 . . . . 2.21 112.25 -170.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.94 -33.14 68.5 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.063 0.459 . . . . 0.42 110.882 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -72.41 -38.33 58.23 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.477 -0.783 . . . . 0.31 111.651 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -65.32 -45.95 82.23 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.705 -0.48 . . . . 1.32 109.705 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.75 90.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.605 -0.725 . . . . 0.42 111.461 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.8 -29.92 70.9 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.018 0.437 . . . . 0.55 110.386 -177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -58.8 -27.97 65.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.718 -0.673 . . . . 0.39 110.514 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.421 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -68.56 -23.59 75.31 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 121.243 -0.503 . . . . 0.27 113.145 -178.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.19 21.93 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 120.938 0.399 . . . . 2.43 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.509 ' OE1' ' HB3' ' A' ' 76' ' ' ALA . 32.9 mm-40 -82.55 -46.39 13.43 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.713 -0.676 . . . . 1.83 112.057 -175.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.453 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 39.0 m-85 -122.08 73.33 36.67 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 121.144 0.497 . . . . 0.69 110.107 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . 0.414 ' O ' ' HB2' ' A' ' 141' ' ' LYS . 54.9 Cg_endo -68.69 -25.79 33.66 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.994 2.463 . . . . 0.63 112.895 -171.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' HG13 ' A' ' 142' ' ' VAL . 3.6 m-85 -68.72 -50.6 49.44 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.546 -0.297 . . . . 2.31 111.166 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.49 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -66.39 -44.35 83.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.676 -0.49 . . . . 1.02 109.676 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.421 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -55.34 -46.54 76.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.016 0.436 . . . . 0.35 110.612 177.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 137' ' ' PRO . 0.8 OUTLIER -47.59 -67.43 0.28 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.252 -0.886 . . . . 2.58 111.447 174.704 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.7 m -63.93 -23.07 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-N 115.014 -0.994 . . . . 0.5 112.798 -174.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.49 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 22.2 m-30 -77.59 -44.54 28.06 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.316 -0.553 . . . . 0.62 110.746 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -71.07 -35.27 71.82 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.13 0.49 . . . . 2.58 110.13 -178.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 29.1 m -82.6 167.57 18.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.37 -0.832 . . . . 1.32 110.307 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -78.79 55.25 4.2 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.895 -0.669 . . . . 1.09 111.502 176.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.502 ' HG2' ' HB ' ' A' ' 142' ' ' VAL . 15.7 tppt? -108.84 -76.3 0.62 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.228 -0.286 . . . . 1.98 110.228 -179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.2 80.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.34 110.55 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.33 68.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.51 111.471 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -85.44 -38.07 19.07 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.187 -0.46 . . . . 2.82 111.111 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -58.34 -39.98 80.93 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.157 0.503 . . . . 0.49 109.783 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.526 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -65.64 -31.52 72.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.444 -0.798 . . . . 0.59 111.093 178.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 64.24 61.04 6.39 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.938 -0.649 . . . . 1.62 111.673 -177.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.697 ' HG3' ' ND2' ' A' ' 155' ' ' ASN . 3.1 pt-20 -150.37 7.91 0.6 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.13 0.419 . . . . 4.12 112.13 -175.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.697 ' ND2' ' HG3' ' A' ' 154' ' ' GLU . 58.9 m-80 . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.621 -0.704 . . . . 4.01 109.702 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 24.3 ptm . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.258 -0.275 . . . . 23.59 110.258 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 74.44 -106.76 2.11 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.775 -0.726 . . . . 22.47 111.501 -176.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.1 t -102.77 85.98 2.66 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 21.51 110.175 177.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 19.7 m -125.67 -15.74 5.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.955 -0.566 . . . . 20.19 110.935 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 22.3 p80 -162.89 41.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.57 -0.287 . . . . 21.42 111.391 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.98 81.15 0.66 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.971 0.415 . . . . 18.2 110.479 177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -160.86 70.54 0.39 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.385 0.612 . . . . 16.06 110.522 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -66.36 -28.06 68.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.711 -0.677 . . . . 13.27 109.565 176.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -136.98 115.67 12.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.547 -0.752 . . . . 12.33 109.366 173.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -115.47 -14.52 11.55 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.822 -0.351 . . . . 11.33 111.092 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 18.4 m -85.26 88.36 7.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 7.95 109.94 178.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 39.1 t -79.99 118.82 22.06 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.141 -0.481 . . . . 7.36 110.616 -177.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -94.45 14.22 65.75 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.869 -0.682 . . . . 4.57 111.62 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -152.82 55.13 0.78 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.055 0.455 . . . . 4.52 111.041 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 54.7 tpp -65.52 112.59 3.66 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.677 -0.49 . . . . 2.0 109.677 176.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -63.18 148.04 49.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.74 -0.664 . . . . 1.47 111.045 -174.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.402 ' H ' ' HB3' ' A' ' 5' ' ' ASP . 68.6 mttm -113.83 165.68 12.33 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.887 -0.597 . . . . 3.15 109.68 177.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -55.33 -51.11 67.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 2.35 110.254 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -77.75 10.32 2.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.868 -0.605 . . . . 4.16 112.463 -179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 2' ' ' LYS . 30.6 t70 -102.04 -19.57 15.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.127 0.489 . . . . 2.57 110.633 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.45 ' HB ' ' HD3' ' A' ' 11' ' ' ARG . 50.9 mt -74.02 138.93 76.01 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.012 -0.736 . . . . 0.69 109.012 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.49 ' HG2' HD22 ' A' ' 110' ' ' LEU . 25.2 Cg_exo -37.69 110.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.492 2.795 . . . . 0.6 112.603 175.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.406 ' O ' ' HB2' ' A' ' 12' ' ' ASP . . . -70.06 -17.39 63.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.681 -0.691 . . . . 0.57 111.923 -171.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -69.55 -32.3 71.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.923 0.868 . . . . 1.37 108.911 176.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.444 ' CG ' HD23 ' A' ' 110' ' ' LEU . 81.1 t80 -82.57 -38.11 24.15 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.044 -1.435 . . . . 0.8 110.816 -178.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.45 ' HD3' ' HB ' ' A' ' 6' ' ' ILE . 50.6 mtm180 -67.18 -27.99 67.73 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.737 0.78 . . . . 1.73 109.622 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 1.0 OUTLIER -69.93 -10.59 59.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.289 -1.323 . . . . 1.02 111.068 176.038 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 83.9 mt -97.95 -16.4 19.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.42 -0.355 . . . . 0.93 110.311 176.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.3 mtm -82.24 135.13 47.77 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.316 -0.402 . . . . 1.15 111.209 -174.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.435 ' HD3' HD21 ' A' ' 139' ' ' LEU . 72.1 Cg_endo -75.48 160.62 38.38 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.881 2.387 . . . . 0.9 112.489 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -43.65 -49.1 8.2 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 123.255 2.637 . . . . 0.96 112.913 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.18 -60.03 2.76 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 121.087 0.47 . . . . 1.83 111.412 179.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 -8.46 54.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.82 112.007 -173.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -96.84 -34.66 11.2 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.502 -0.317 . . . . 2.16 110.749 179.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -52.05 -47.65 64.99 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.361 0.413 . . . . 1.06 111.645 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.485 ' O ' HD23 ' A' ' 25' ' ' LEU . 33.7 t80 -60.56 -60.24 4.11 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.172 -0.467 . . . . 0.65 111.571 179.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.488 HD21 ' CE1' ' A' ' 100' ' ' TYR . 34.6 mt -75.82 -4.65 41.85 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 119.274 0.943 . . . . 1.13 112.336 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 55.4 tt0 -68.41 -36.19 78.73 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.498 -0.556 . . . . 2.06 109.498 163.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.3 m-80 -78.02 -50.08 12.79 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.267 -0.879 . . . . 1.84 112.253 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.4 mm? -55.25 138.04 46.01 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.259 0.552 . . . . 1.05 110.786 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.3 m -121.58 -67.61 0.95 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 1.78 111.278 -174.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -164.07 -52.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 111.74 0.274 . . . . 2.39 111.74 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -70.03 -30.8 69.69 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.829 -0.7 . . . . 0.93 111.552 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.708 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.5 p30 -72.53 -41.65 65.6 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.179 -0.511 . . . . 2.25 110.526 175.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.26 -20.68 63.13 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.13 0.49 . . . . 1.31 110.776 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 58.2 m -67.8 -30.07 69.4 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.631 -0.713 . . . . 0.8 110.936 178.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.708 HG12 ' O ' ' A' ' 29' ' ' ASP . 8.0 p -90.81 -30.12 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.731 0 CA-C-N 116.29 -0.414 . . . . 0.85 110.773 -178.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.615 ' O ' HG22 ' A' ' 36' ' ' VAL . 4.4 mm? -53.92 -45.85 71.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.351 0.12 . . . . 0.98 110.967 173.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.521 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 17.8 pttp -59.9 -27.08 66.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.591 -0.444 . . . . 2.41 110.959 -178.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -78.18 -39.02 42.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.8 0.333 . . . . 1.96 110.439 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.629 HG13 ' O ' ' A' ' 32' ' ' VAL . 2.3 m -69.83 -37.41 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.98 110.219 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 24.9 m-85 -67.49 -38.22 84.03 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.238 1.199 . . . . 0.83 114.238 173.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -85.25 16.87 3.33 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.627 -0.829 . . . . 2.18 110.291 -178.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.93 11.57 17.87 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.277 -0.874 . . . . 1.56 109.541 174.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.69 -159.97 32.72 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.521 -0.763 . . . . 1.54 111.849 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.55 160.0 93.89 Favored 'Cis proline' 0 C--O 1.233 0.274 0 C-N-CA 123.675 -1.386 . . . . 1.68 112.839 1.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.551 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 60.0 m-85 -116.6 140.92 48.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.629 -0.714 . . . . 1.28 110.106 -178.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.3 -12.97 60.16 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.634 -0.712 . . . . 3.51 110.289 -178.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.591 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -158.06 165.58 34.68 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.116 -0.493 . . . . 1.52 110.286 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.2 m -65.89 -30.15 70.7 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.118 0.485 . . . . 1.18 110.588 178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -54.08 -42.82 69.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.435 -0.802 . . . . 2.24 112.087 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.591 ' HG3' HD21 ' A' ' 44' ' ' ASN . 30.3 mt-10 -63.76 -33.14 74.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.418 -0.355 . . . . 2.26 111.131 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.5 t -73.21 -32.23 64.66 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.849 -0.426 . . . . 1.19 109.849 177.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.7 -40.84 90.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.406 0.622 . . . . 0.55 109.556 175.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.81 -46.18 90.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.035 -0.984 . . . . 0.57 110.879 175.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.421 ' CB ' ' HB ' ' A' ' 36' ' ' VAL . . . -56.77 -39.14 73.49 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.053 -0.522 . . . . 0.5 110.973 177.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 33' ' ' LEU . 14.1 mt -71.21 -42.25 69.2 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.83 -0.623 . . . . 0.45 111.448 178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -61.14 -34.66 75.35 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.874 0.368 . . . . 1.22 111.429 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -73.95 -38.29 64.29 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.056 -0.52 . . . . 3.05 111.657 -179.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -91.48 -36.89 13.49 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.228 0.455 . . . . 1.48 112.228 -175.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -145.18 88.27 6.83 Favored Pre-proline 0 C--N 1.32 -0.715 0 N-CA-C 109.336 -0.616 . . . . 1.16 109.336 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.49 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . 63.1 Cg_exo -41.18 -54.41 2.59 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 124.102 3.201 . . . . 0.58 113.751 -170.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 6.1 mp0 -58.96 -36.0 74.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 114.945 -1.025 . . . . 2.45 112.326 -177.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.1 mt -68.55 -36.6 79.01 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 120.011 -0.676 . . . . 1.42 109.315 -175.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -62.23 -32.13 81.52 Favored Glycine 0 N--CA 1.445 -0.729 0 CA-C-N 114.639 -1.164 . . . . 0.37 111.707 176.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.27 -38.79 63.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.75 0.31 . . . . 0.48 110.547 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 58' ' ' GLU . 32.4 mmmt -63.2 -42.12 99.28 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.116 -0.493 . . . . 2.17 110.602 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.63 -30.07 16.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.392 -0.367 . . . . 1.12 110.718 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.46 -51.86 63.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.549 -0.296 . . . . 1.7 110.628 178.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.486 ' O ' ' HG3' ' A' ' 69' ' ' MET . 20.9 pttp -60.11 -35.49 75.34 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.774 0.797 . . . . 3.96 109.573 -177.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.474 HD13 ' C ' ' A' ' 66' ' ' LEU . 1.5 tm? -65.04 -48.5 73.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 114.387 -1.279 . . . . 1.5 110.303 178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.581 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 84.2 t60 -77.98 -32.12 51.09 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 109.52 -0.548 . . . . 2.34 109.52 -170.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.73 -43.37 93.6 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.379 -0.828 . . . . 0.4 111.528 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 60.7 mtm -56.32 -52.15 65.59 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.649 0.738 . . . . 0.72 109.367 174.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 66' ' ' LEU . 52.9 t -51.66 -49.47 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 CA-C-N 114.107 -1.406 . . . . 0.79 110.917 176.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.1 mmmt -63.2 -40.63 98.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.749 . . . . 1.47 111.928 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.9 t -60.56 -40.05 90.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.022 0.439 . . . . 1.26 110.666 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.558 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 95.2 mttt -74.0 -41.71 61.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.836 -0.62 . . . . 1.54 110.788 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 65.5 mt -69.93 -26.24 29.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.196 0.522 . . . . 0.34 110.807 176.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.6 81.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.579 0.704 . . . . 0.35 109.924 172.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -86.07 -2.29 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.743 -1.117 . . . . 0.49 110.743 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.471 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 11.7 tp -95.05 133.28 39.02 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.823 -0.626 . . . . 0.71 109.731 -176.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.41 151.2 50.54 Favored Glycine 0 C--O 1.226 -0.394 0 C-N-CA 120.8 -0.714 . . . . 0.76 112.0 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -39.17 -40.4 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.391 3.394 . . . . 1.56 114.495 -176.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -70.02 -46.24 65.5 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 121.263 -0.175 . . . . 2.52 111.236 -176.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.471 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -80.29 -33.17 37.91 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.606 0.717 . . . . 0.36 109.974 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -58.03 -44.4 87.32 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.676 -1.147 . . . . 2.04 111.304 177.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.23 -38.83 96.29 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 0.41 111.927 178.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 15.4 t80 -68.47 -44.05 75.65 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.526 0.203 . . . . 1.65 110.998 176.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.22 85.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.034 0.445 . . . . 0.41 111.024 -178.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -62.46 -39.71 94.3 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.83 178.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -71.06 -51.28 26.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.094 -0.503 . . . . 2.12 111.529 -177.263 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 8.3 p -59.15 -39.91 83.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.952 0.406 . . . . 0.57 110.997 -176.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.7 mt -70.34 -41.03 78.44 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-N 116.091 -0.504 . . . . 1.09 111.603 -179.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 14.8 pt-20 -69.68 -28.01 65.49 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 120.454 -0.498 . . . . 2.82 110.668 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 87' ' ' LYS . 98.2 mt -69.77 -48.96 61.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.014 0.435 . . . . 0.51 110.044 175.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.49 -33.93 76.8 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.92 -0.582 . . . . 0.64 110.734 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 59.0 ttp180 -56.96 -39.78 75.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.955 -0.566 . . . . 4.42 110.38 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.424 ' O ' ' HG3' ' A' ' 98' ' ' ARG . . . -66.98 -30.72 76.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.927 -0.654 . . . . 0.66 112.015 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 mm -63.53 -53.8 40.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.075 0.464 . . . . 0.55 110.542 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -74.48 -15.67 60.88 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.361 -0.382 . . . . 2.7 110.863 177.672 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.03 71.25 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 119.936 -0.706 . . . . 0.63 109.989 170.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.456 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 47.1 mtt180 -88.77 -9.43 51.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.184 -0.462 . . . . 3.1 110.186 176.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.442 ' HD2' ' HA ' ' A' ' 96' ' ' LYS . 30.6 m-85 -83.25 -43.94 15.51 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.392 -0.596 . . . . 0.97 109.392 167.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.521 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 25.8 m-85 -61.08 -36.3 79.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.192 -0.458 . . . . 1.48 111.778 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.456 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 1.8 p -74.49 -11.44 60.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.772 -0.649 . . . . 0.87 112.737 -176.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 86.74 18.14 58.76 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.839 -0.696 . . . . 1.16 113.225 -176.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -88.71 -42.89 11.68 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.907 0.354 . . . . 1.83 111.236 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 65.41 88.88 0.11 Allowed Pre-proline 0 C--N 1.325 -0.474 0 O-C-N 123.728 0.642 . . . . 1.75 112.321 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.94 144.43 5.96 Favored 'Trans proline' 0 C--O 1.237 0.457 0 C-N-CA 123.62 2.88 . . . . 0.53 113.019 172.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.7 t -79.61 166.0 22.33 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.047 -0.723 . . . . 1.48 109.047 174.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 22.0 ptmt -58.03 -34.44 70.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 118.283 0.492 . . . . 2.88 110.496 -176.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -66.99 -25.55 66.36 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.746 -0.661 . . . . 2.24 111.493 -178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -70.16 -40.59 74.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.347 0.594 . . . . 1.73 109.982 178.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.9 mp -72.41 -39.68 67.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.82 110.716 178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.0 mtpm? -58.32 -47.02 85.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.229 0.538 . . . . 1.74 110.021 176.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -64.53 -39.25 93.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.532 -0.758 . . . . 0.47 112.301 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.9 p -71.88 -31.9 66.9 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.396 0.517 . . . . 1.34 112.396 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.868 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.9 m -78.41 -24.43 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.458 0.647 . . . . 0.65 109.307 179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.57 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 63.5 mttm -53.26 -48.78 67.99 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.276 -0.874 . . . . 1.72 111.385 174.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.527 ' O ' HD13 ' A' ' 120' ' ' LEU . 6.4 mm-40 -70.27 -33.42 71.56 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.391 -0.368 . . . . 2.27 110.922 -171.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.3 m -67.95 -28.03 39.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 C-N-CA 120.231 -0.588 . . . . 0.81 109.95 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.528 HD13 ' HA ' ' A' ' 149' ' ' ALA . 44.3 mt -82.35 -30.31 30.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.81 0.338 . . . . 1.21 110.283 175.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -61.49 -35.42 77.61 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.607 0.718 . . . . 0.95 109.264 177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.618 ' O ' ' HG3' ' A' ' 124' ' ' MET . 10.8 mp -81.87 -45.7 15.13 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 114.755 -1.111 . . . . 1.06 111.369 176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.48 ' CD2' ' HB3' ' A' ' 143' ' ' PHE . 47.4 t80 -74.63 -36.32 62.91 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 119.301 -0.96 . . . . 1.54 111.611 -169.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -66.66 -29.49 69.51 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.221 -0.659 . . . . 1.98 109.221 176.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -102.22 72.1 1.28 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.189 -0.914 . . . . 0.7 110.809 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.618 ' HG3' ' O ' ' A' ' 120' ' ' LEU . 32.0 mtm -150.02 157.47 43.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.691 -0.686 . . . . 0.5 110.669 178.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.4 m -62.57 138.35 58.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.228 0.537 . . . . 1.18 110.445 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -58.49 -37.88 76.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.128 -0.942 . . . . 2.21 112.533 -172.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.92 -34.83 78.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 0.42 110.834 177.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.69 -38.69 56.86 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.985 -0.626 . . . . 0.31 111.64 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -63.79 -45.22 90.7 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.042 0.448 . . . . 1.32 110.608 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.5 -34.0 71.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.77 -0.65 . . . . 0.42 111.782 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -74.23 -30.72 62.3 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.55 109.823 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -60.32 -31.08 69.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.912 -0.586 . . . . 0.39 109.928 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -71.75 -12.03 73.95 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 121.092 -0.575 . . . . 0.27 112.849 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -86.51 -33.29 20.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.58 0.705 . . . . 2.43 109.781 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.558 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 69.6 mm-40 -92.25 -38.8 11.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.001 -1.0 . . . . 1.83 110.934 -177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -131.26 75.14 78.19 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-O 121.215 0.531 . . . . 0.69 110.166 177.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -66.86 -29.38 41.77 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.433 2.756 . . . . 0.63 113.043 -175.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.583 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 26.0 t80 -74.45 -37.04 63.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.949 0.404 . . . . 2.31 109.933 -177.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.435 HD21 ' HD3' ' A' ' 15' ' ' PRO . 79.0 mt -74.9 -46.64 34.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.2 -0.454 . . . . 1.02 110.302 177.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -56.95 -39.16 74.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.35 109.907 177.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.583 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 55.2 tttp -44.4 -68.31 0.21 Allowed 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.131 -0.94 . . . . 2.58 111.701 172.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG12 ' HD3' ' A' ' 147' ' ' LYS . 2.2 m -71.9 -16.24 18.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-N 114.997 -1.001 . . . . 0.5 112.753 -173.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.48 ' HB3' ' CD2' ' A' ' 121' ' ' TYR . 22.3 m-30 -84.95 -36.41 21.41 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.433 -0.507 . . . . 0.62 110.941 178.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 48.0 mt-10 -66.42 -52.35 47.5 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.081 0.467 . . . . 2.58 109.881 175.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -75.16 159.45 31.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.682 -0.69 . . . . 1.32 109.929 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.07 52.41 3.32 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.738 -0.744 . . . . 1.09 111.828 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.443 ' HD3' HG12 ' A' ' 142' ' ' VAL . 61.6 tttm -100.06 -64.25 1.06 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.789 0.328 . . . . 1.98 110.155 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -71.45 -33.76 69.64 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.301 0.572 . . . . 0.34 109.544 175.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.528 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -55.79 -37.91 69.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.098 -0.956 . . . . 0.51 111.55 177.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -85.81 -20.21 29.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.541 -0.3 . . . . 2.82 111.413 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.437 ' HD2' HG21 ' A' ' 114' ' ' VAL . 68.0 t80 -74.34 -34.07 63.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.532 0.682 . . . . 0.49 109.316 172.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.868 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -79.92 -42.53 23.89 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.189 -0.914 . . . . 0.59 111.565 177.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 100.3 1.44 55.72 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.616 -0.994 . . . . 1.62 110.616 -170.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.459 ' HG2' ' HB1' ' A' ' 152' ' ' ALA . 24.7 mm-40 -88.29 128.25 35.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.054 -0.573 . . . . 4.12 110.137 -177.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.525 HD22 ' N ' ' A' ' 155' ' ' ASN . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 119.045 -0.502 . . . . 4.01 109.834 174.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.519 0.2 . . . . 23.59 110.481 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -64.37 -31.55 81.24 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 121.006 -0.616 . . . . 22.47 111.867 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 15.7 m -126.75 136.38 52.34 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.351 -0.611 . . . . 21.51 109.351 175.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 16.1 t -75.67 87.11 2.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.137 0.494 . . . . 20.19 110.317 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -75.81 156.8 34.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.82 -0.627 . . . . 21.42 110.744 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -86.61 132.26 33.94 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.038 -0.528 . . . . 18.2 109.685 177.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -69.47 103.16 1.96 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.698 0.761 . . . . 16.06 110.976 -178.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 79.9 m80 -70.11 134.64 48.39 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.316 -0.856 . . . . 13.27 110.411 -178.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -84.06 130.76 34.85 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.277 -0.42 . . . . 12.33 110.489 -178.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -114.0 -63.86 1.39 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.007 -0.542 . . . . 11.33 109.788 178.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.1 91.64 8.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.091 0.472 . . . . 7.95 110.029 174.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.6 m -103.44 140.59 37.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.936 -0.575 . . . . 7.36 110.673 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 158.23 -96.24 0.15 Allowed Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.991 -0.623 . . . . 4.57 111.55 -179.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 34.7 m80 -113.75 85.39 2.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.028 0.442 . . . . 4.52 110.511 178.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 7.5 tpt -144.88 129.61 18.18 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.674 -0.694 . . . . 2.0 109.513 -178.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.762 ' CD1' ' HG2' ' A' ' 4' ' ' GLU . 0.8 OUTLIER -44.48 94.94 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 O-C-N 124.185 0.928 . . . . 1.47 111.325 177.79 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 5.3 tmtp? -100.94 50.5 0.87 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.692 -1.14 . . . . 3.15 109.435 -177.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.456 ' CD1' HD12 ' A' ' 6' ' ' ILE . 0.9 OUTLIER 62.06 23.44 13.82 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 107.289 -1.374 . . . . 2.35 107.289 -166.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.762 ' HG2' ' CD1' ' A' ' 1' ' ' PHE . 16.0 mm-40 46.64 17.79 0.06 Allowed 'General case' 0 C--N 1.344 0.335 0 N-CA-C 116.441 2.015 . . . . 4.16 116.441 171.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.9 t70 48.97 29.98 2.59 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.47 0.652 . . . . 2.57 109.9 -172.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.456 HD12 ' CD1' ' A' ' 3' ' ' TYR . 83.2 mt -52.71 132.75 46.78 Favored Pre-proline 0 CA--C 1.519 -0.229 0 CA-C-N 115.673 -0.694 . . . . 0.69 110.376 -174.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -35.22 109.64 0.06 OUTLIER 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 123.982 3.121 . . . . 0.6 112.899 -175.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.29 -17.02 51.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.59 -0.732 . . . . 0.57 111.597 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -67.7 -35.46 78.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.703 . . . . 1.37 109.275 177.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.493 ' HA ' HD13 ' A' ' 13' ' ' LEU . 41.4 t80 -89.1 -24.45 22.25 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.383 -1.28 . . . . 0.8 111.098 -176.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 -71.21 -22.93 61.95 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.041 -0.725 . . . . 1.73 109.041 177.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.11 -24.52 66.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.774 -1.103 . . . . 1.02 110.541 172.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 10' ' ' TYR . 9.9 mp -80.37 -43.89 20.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.481 -0.781 . . . . 0.93 110.669 178.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.406 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 69.8 mtm -68.36 131.54 91.77 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.038 -0.528 . . . . 1.15 110.844 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.556 ' HD3' HD21 ' A' ' 139' ' ' LEU . 26.9 Cg_endo -63.24 152.44 79.78 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.9 111.989 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 57.6 Cg_exo -53.08 -27.46 36.65 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.621 2.88 . . . . 0.96 112.847 -178.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.56 ' O ' HD21 ' A' ' 66' ' ' LEU . 31.0 mt-10 -64.59 -50.17 68.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.898 -0.592 . . . . 1.83 110.641 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.2 -30.65 70.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.998 0.428 . . . . 0.82 110.978 -178.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.406 ' HD2' ' O ' ' A' ' 14' ' ' MET . 41.0 mtp180 -75.64 -32.77 60.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.606 -0.725 . . . . 2.16 110.505 179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -52.5 -45.9 66.41 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.866 -0.606 . . . . 1.06 111.318 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.528 ' O ' HD23 ' A' ' 25' ' ' LEU . 44.1 t80 -57.72 -63.21 1.32 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.952 -0.567 . . . . 0.65 111.657 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.523 HD21 ' CE1' ' A' ' 100' ' ' TYR . 48.9 mt -73.45 -9.91 59.18 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 119.539 1.063 . . . . 1.13 112.484 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.94 -36.89 80.9 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.013 0.435 . . . . 2.06 110.059 164.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -80.47 -48.76 12.34 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.958 -0.564 . . . . 1.84 111.142 -178.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.574 ' HB3' ' CE ' ' A' ' 30' ' ' LYS . 4.4 mm? -57.61 131.52 50.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.439 0.637 . . . . 1.05 111.736 179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 14.6 m -130.79 -90.39 0.45 Allowed 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.341 -0.845 . . . . 1.78 111.351 -175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -125.08 -62.13 1.24 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.086 0.402 . . . . 2.39 112.086 -171.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -61.75 -45.63 95.86 Favored Glycine 0 N--CA 1.453 -0.168 0 C-N-CA 121.101 -0.571 . . . . 0.93 113.109 -175.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.601 ' O ' HG12 ' A' ' 32' ' ' VAL . 11.7 m-20 -72.49 -32.61 66.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.22 0.533 . . . . 2.25 110.276 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.574 ' CE ' ' HB3' ' A' ' 25' ' ' LEU . 1.1 tppp? -55.54 -34.84 65.07 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 1.31 111.049 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 74.6 m -51.99 -41.87 62.5 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.128 -0.942 . . . . 0.8 112.292 176.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.601 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -86.68 -24.2 6.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.464 -0.335 . . . . 0.85 111.49 -171.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.548 HD12 ' HE1' ' A' ' 37' ' ' PHE . 4.3 mm? -49.92 -53.08 28.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.789 0.328 . . . . 0.98 111.873 174.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -64.06 -21.08 66.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 2.41 111.373 -175.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -76.66 -22.08 54.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.19 -0.459 . . . . 1.96 110.829 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.592 HG12 ' OH ' ' A' ' 42' ' ' TYR . 87.6 t -91.84 -52.3 10.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.578 0.704 . . . . 0.98 110.189 177.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.548 ' HE1' HD12 ' A' ' 33' ' ' LEU . 64.8 m-85 -58.24 -39.58 79.5 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.941 1.089 . . . . 0.83 113.941 177.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -85.07 16.89 3.2 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 119.847 -0.741 . . . . 2.18 110.862 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.78 21.0 11.6 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.557 -0.747 . . . . 1.56 109.945 173.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -80.77 -153.91 9.95 Favored Glycine 0 N--CA 1.452 -0.242 0 N-CA-C 111.32 -0.712 . . . . 1.54 111.32 174.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -83.52 150.64 65.58 Favored 'Cis proline' 0 C--N 1.344 0.318 0 CA-C-N 119.331 1.565 . . . . 1.68 112.761 -2.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.592 ' OH ' HG12 ' A' ' 36' ' ' VAL . 13.7 m-85 -86.5 134.14 33.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.915 -0.584 . . . . 1.28 110.011 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -89.27 -17.36 29.15 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.315 -0.857 . . . . 3.51 109.219 177.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.46 HD21 ' HG3' ' A' ' 47' ' ' GLU . 4.8 p30 -145.99 163.37 35.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.28 -0.873 . . . . 1.52 110.011 -177.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.0 m -65.55 -41.81 92.58 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.973 0.416 . . . . 1.18 111.436 -177.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -55.7 -34.92 65.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.556 -0.747 . . . . 2.24 112.534 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.46 ' HG3' HD21 ' A' ' 44' ' ' ASN . 31.6 mt-10 -56.76 -39.49 74.13 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.034 0.383 . . . . 2.26 112.034 -177.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.2 t -69.04 -43.87 73.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.958 0.409 . . . . 1.19 109.931 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.1 mt -64.52 -44.11 96.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.692 -0.686 . . . . 0.55 110.375 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.29 79.5 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.141 -0.936 . . . . 0.57 112.069 178.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.424 ' CB ' HG13 ' A' ' 36' ' ' VAL . . . -64.99 -34.76 79.2 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.937 0.399 . . . . 0.5 110.81 -177.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.507 HD21 HD13 ' A' ' 33' ' ' LEU . 16.9 mt -69.49 -32.2 70.93 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.912 -0.586 . . . . 0.45 111.318 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -67.44 -40.73 85.44 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.836 -0.346 . . . . 1.22 111.188 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -66.4 -28.51 68.68 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.223 0.535 . . . . 3.05 110.869 179.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.537 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 40.3 mmtt -85.69 -44.12 12.83 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.892 -0.595 . . . . 1.48 112.043 176.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.4 m -151.5 103.93 2.91 Favored Pre-proline 0 C--N 1.315 -0.894 0 C-N-CA 120.712 -0.395 . . . . 1.16 111.361 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -41.31 -62.69 0.37 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 123.87 3.047 . . . . 0.58 113.485 -173.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.36 -29.24 69.94 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 114.801 -1.09 . . . . 2.45 111.387 -177.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tt -73.22 -42.18 62.91 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.407 -0.96 . . . . 1.42 108.407 -176.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.414 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -65.45 -25.6 71.44 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 114.353 -1.294 . . . . 0.37 111.467 175.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -73.78 -32.03 63.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.938 0.399 . . . . 0.48 110.444 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -67.7 -37.99 83.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.282 -0.417 . . . . 2.17 111.178 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.0 p -80.13 -29.56 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.176 0.512 . . . . 1.12 110.061 175.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -61.15 -48.91 79.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.86 -0.609 . . . . 1.7 110.782 177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.17 -30.57 71.16 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-O 121.397 0.617 . . . . 3.96 109.432 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.56 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.4 OUTLIER -73.33 -3.85 29.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.075 -0.966 . . . . 1.5 111.872 -178.17 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.6 t-80 -122.13 -29.68 4.17 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.126 -0.63 . . . . 2.34 110.487 171.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.37 -47.34 64.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.659 0.244 . . . . 0.4 111.659 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 35.7 mtm -62.63 -39.33 93.49 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.747 0.784 . . . . 0.72 109.484 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.437 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 97.0 t -69.55 -35.49 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 CA-C-N 114.709 -1.132 . . . . 0.79 110.583 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -61.12 -39.65 90.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.947 -0.57 . . . . 1.47 110.568 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.7 m -55.44 -36.5 66.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.413 0.625 . . . . 1.26 110.371 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.422 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 43.7 mttp -77.69 -54.25 6.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.996 -1.002 . . . . 1.54 110.118 177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.41 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 61.6 mt -61.76 -23.2 30.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.374 0.607 . . . . 0.34 111.361 -177.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.82 65.5 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.66 -0.7 . . . . 0.35 109.856 177.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.85 -2.98 52.92 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.813 -1.085 . . . . 0.49 110.016 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.447 HD13 ' HB2' ' A' ' 135' ' ' GLN . 6.8 tp -91.23 135.46 33.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.001 -0.999 . . . . 0.71 109.58 -176.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.68 159.75 48.24 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.803 -0.713 . . . . 0.76 111.829 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_exo -47.73 -38.22 29.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 123.304 2.669 . . . . 1.56 113.227 -177.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -63.53 -47.73 80.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.343 -0.39 . . . . 2.52 111.228 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 128' ' ' GLY . . . -87.05 -29.79 21.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.104 -0.498 . . . . 0.36 111.419 -174.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.41 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 37.0 ttpt -57.87 -41.74 83.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.09 -0.505 . . . . 2.04 111.319 178.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.09 -41.26 96.45 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.564 -0.826 . . . . 0.41 112.083 179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -71.57 -41.56 68.87 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.801 -0.2 . . . . 1.65 111.057 178.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -57.81 -49.57 76.19 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.871 0.367 . . . . 0.41 111.666 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.93 -29.3 69.69 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.353 -0.385 . . . . 1.96 111.522 -178.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.702 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 0.4 OUTLIER -88.42 -38.29 15.17 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 111.743 0.275 . . . . 2.12 111.743 -176.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 17.5 p -60.3 -39.8 88.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.101 0.477 . . . . 0.57 109.769 176.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -63.82 -41.32 92.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.681 -0.69 . . . . 1.09 110.879 175.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.702 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 8.0 pt-20 -67.16 -32.72 74.01 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 120.837 -0.345 . . . . 2.82 110.736 -177.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 87' ' ' LYS . 74.3 mt -73.23 -52.31 22.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.82 0.343 . . . . 0.51 110.546 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.8 -43.34 98.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.076 -0.511 . . . . 0.64 111.206 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 12.3 ptt180 -66.3 -23.38 66.37 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.132 -0.485 . . . . 4.42 110.454 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -72.0 -41.33 55.0 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.005 -0.617 . . . . 0.66 112.137 -179.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.0 mm -65.61 -44.39 93.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.818 0.818 . . . . 0.55 109.125 177.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.4 ' HD2' HD12 ' A' ' 22' ' ' LEU . 14.8 ttpp -88.45 29.03 1.02 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.673 -1.148 . . . . 2.7 109.887 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 93' ' ' ARG . . . -121.75 -34.48 3.39 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.113 -0.949 . . . . 0.63 110.567 168.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.626 ' O ' ' HB3' ' A' ' 103' ' ' ASN . 17.1 ptm180 -80.88 0.07 36.81 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 120.194 -0.602 . . . . 3.1 109.498 176.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.475 ' CD1' ' HG3' ' A' ' 4' ' ' GLU . 5.6 m-85 -81.27 -28.78 34.56 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 110.024 -0.361 . . . . 0.97 110.024 165.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.523 ' CE1' HD21 ' A' ' 22' ' ' LEU . 30.9 m-85 -72.44 -34.18 67.59 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.963 0.411 . . . . 1.48 111.272 -178.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.4 p -73.53 -12.08 60.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.659 -0.701 . . . . 0.87 112.554 -173.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.78 55.08 Favored Glycine 0 N--CA 1.453 -0.232 0 N-CA-C 111.103 -0.799 . . . . 1.16 111.103 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.626 ' HB3' ' O ' ' A' ' 98' ' ' ARG . 40.6 t-20 -87.89 162.3 17.0 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.038 -1.097 . . . . 1.83 108.038 176.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.401 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 20.6 mt-10 -139.46 97.92 8.26 Favored Pre-proline 0 C--N 1.32 -0.705 0 O-C-N 122.114 -0.366 . . . . 1.75 110.84 -178.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 10.7 Cg_endo -57.05 139.89 91.17 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.443 2.095 . . . . 0.53 111.634 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 9.3 t -78.55 165.98 23.1 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 109.49 -0.559 . . . . 1.48 109.49 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 21.1 pttp -58.0 -33.78 69.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.279 0.561 . . . . 2.88 110.373 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.97 -25.92 65.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.438 -0.801 . . . . 2.24 111.015 -179.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -67.81 -45.24 75.3 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.364 -0.606 . . . . 1.73 109.364 176.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.447 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.1 mp -63.77 -44.99 91.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.372 -0.831 . . . . 0.82 110.4 177.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 30.1 mtpp -56.29 -42.41 77.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 1.74 110.432 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -66.23 -46.26 77.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.572 -0.74 . . . . 0.47 111.596 177.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 18.1 p -62.74 -40.03 95.96 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.169 0.433 . . . . 1.34 112.169 -177.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.916 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.4 m -77.73 -23.67 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.828 0.823 . . . . 0.65 109.598 -177.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.478 ' HG2' HD22 ' A' ' 155' ' ' ASN . 41.7 ttmt -67.19 -39.46 86.39 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.093 -0.958 . . . . 1.72 111.26 177.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 119' ' ' LYS . 14.1 mm-40 -71.45 -34.32 70.13 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.463 -0.495 . . . . 2.27 110.772 -177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.646 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.8 m -65.78 -33.55 64.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 C-N-CA 120.377 -0.529 . . . . 0.81 109.932 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' A' ' 149' ' ' ALA . 62.8 mt -72.18 -33.94 68.06 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.76 -0.459 . . . . 1.21 109.76 174.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.1 ttpt -56.93 -44.24 82.3 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.891 -0.781 . . . . 0.95 108.891 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.4 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.6 mp -70.91 -48.52 53.18 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.872 -1.058 . . . . 1.06 111.467 174.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' A' ' 129' ' ' LYS . 51.0 t80 -71.24 -30.87 66.86 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 119.498 -0.881 . . . . 1.54 111.526 -167.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -66.84 -35.05 79.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.032 0.444 . . . . 1.98 110.793 176.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -88.58 -10.21 49.54 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.88 0.696 . . . . 0.7 112.88 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.5 mtm -71.15 156.36 39.67 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.837 -0.345 . . . . 0.5 111.692 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.434 ' O ' ' HG2' ' A' ' 129' ' ' LYS . 46.8 t -53.2 141.15 24.22 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.001 -0.545 . . . . 1.18 110.155 173.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.37 -48.9 77.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 120.816 0.341 . . . . 2.21 110.924 -175.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.41 -34.66 75.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.541 . . . . 0.42 110.815 177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 81' ' ' ALA . . . -73.13 -44.59 35.0 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.751 -0.659 . . . . 0.31 112.607 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.54 ' HB2' ' CE1' ' A' ' 121' ' ' TYR . 14.1 ptmm? -71.15 -29.08 64.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.989 0.423 . . . . 1.32 110.918 -177.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.37 65.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.269 -0.423 . . . . 0.42 110.985 174.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -67.33 -27.91 67.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.296 0.57 . . . . 0.55 109.702 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.49 -25.21 67.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.224 -0.898 . . . . 0.39 110.529 174.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.501 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -75.07 -12.48 83.39 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.891 -0.671 . . . . 0.27 113.344 -177.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 66.6 mttt -90.52 -48.23 7.22 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.434 0.635 . . . . 2.43 110.01 -178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.447 ' HB2' HD13 ' A' ' 77' ' ' LEU . 1.8 mp0 -79.8 -31.97 40.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.115 -0.948 . . . . 1.83 110.732 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.437 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 5.9 m-85 -124.75 74.64 64.36 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.786 0.327 . . . . 0.69 110.755 175.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -68.14 -33.97 23.49 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.954 2.436 . . . . 0.63 112.948 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 37.3 t80 -73.93 -42.38 60.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.724 0.297 . . . . 2.31 110.718 -176.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.556 HD21 ' HD3' ' A' ' 15' ' ' PRO . 58.2 mt -70.92 -44.27 66.53 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.942 -0.303 . . . . 1.02 110.624 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.501 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -59.36 -39.42 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.83 0.348 . . . . 0.35 110.148 178.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.2 tttm -46.12 -65.75 0.5 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.315 -0.857 . . . . 2.58 111.456 172.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -69.19 -18.59 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.391 -0.822 . . . . 0.5 112.883 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 18.6 m-85 -81.75 -41.99 20.43 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.103 -0.639 . . . . 0.62 110.933 178.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -70.32 -39.17 74.92 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.115 0.483 . . . . 2.58 110.6 -179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.0 t -83.95 161.66 20.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.615 -0.721 . . . . 1.32 109.306 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -77.67 57.74 3.82 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.626 -0.797 . . . . 1.09 112.678 -178.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -106.55 -69.18 0.84 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.798 -0.445 . . . . 1.98 109.798 175.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -67.04 -40.69 87.23 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.057 0.456 . . . . 0.34 109.783 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' A' ' 118' ' ' LEU . . . -56.99 -43.52 81.78 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.521 -0.763 . . . . 0.51 110.652 176.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.02 -38.56 86.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.052 0.453 . . . . 2.82 110.413 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -67.52 -34.37 76.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.615 -0.72 . . . . 0.49 111.305 179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.916 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -89.37 -37.26 14.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.933 0.716 . . . . 0.59 112.933 -174.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 155' ' ' ASN . . . 112.51 19.75 6.88 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.814 -0.914 . . . . 1.62 110.814 -169.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.419 ' O ' ' HB3' ' A' ' 155' ' ' ASN . 26.1 tt0 75.32 -32.3 0.22 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.646 1.179 . . . . 4.12 112.991 177.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.478 HD22 ' HG2' ' A' ' 115' ' ' LYS . 25.5 t-20 . . . . . 0 C--O 1.247 0.95 0 O-C-N 124.497 1.123 . . . . 4.01 110.294 -175.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 34.2 mtt . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.744 0.306 . . . . 23.59 110.791 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 119.93 90.19 1.21 Allowed Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 111.269 -0.732 . . . . 22.47 111.269 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 38.3 t -61.63 124.02 19.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.974 0.416 . . . . 21.51 110.651 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 27.9 m -96.5 30.98 2.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.074 -0.512 . . . . 20.19 110.338 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 42.1 m80 61.47 44.32 9.44 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.515 -0.766 . . . . 21.42 110.811 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -126.53 127.55 45.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.348 -0.842 . . . . 18.2 109.309 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 -81.75 98.96 8.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.931 0.396 . . . . 16.06 110.405 179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 33.5 t60 -128.9 87.01 2.51 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.99 -0.55 . . . . 13.27 109.874 -178.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -87.78 62.09 6.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.167 -0.469 . . . . 12.33 111.516 -175.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 64.3 m80 67.04 -81.4 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.393 -0.821 . . . . 11.33 111.43 178.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.5 m 61.32 49.81 5.15 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.182 0.515 . . . . 7.95 111.494 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 46.5 t -134.8 -50.28 0.77 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.139 -0.482 . . . . 7.36 110.765 178.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 88.28 -14.31 59.64 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.85 -0.691 . . . . 4.57 112.419 179.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -141.24 25.71 2.05 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.98 0.419 . . . . 4.52 110.751 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 25.0 ttm -127.27 121.05 30.09 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.128 0.489 . . . . 2.0 110.819 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -77.16 161.31 28.31 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.405 -0.816 . . . . 1.47 110.483 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HB3' ' OD1' ' A' ' 5' ' ' ASP . 75.3 tttt -135.62 158.1 45.23 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.043 -0.725 . . . . 3.15 109.043 170.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -49.27 -51.52 33.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.167 0.508 . . . . 2.35 110.288 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.32 -20.34 66.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.245 -0.889 . . . . 4.16 112.405 -178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.537 ' OD1' ' HB3' ' A' ' 2' ' ' LYS . 2.6 m-20 -88.58 -18.8 27.29 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.865 0.364 . . . . 2.57 110.971 -175.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.2 mt -72.86 131.25 84.19 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.795 -0.817 . . . . 0.69 108.795 176.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -41.33 113.28 0.25 Allowed 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 123.217 2.611 . . . . 0.6 112.163 177.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.59 -19.65 65.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.443 -0.798 . . . . 0.57 112.218 -171.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.44 -33.47 76.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.773 0.797 . . . . 1.37 109.372 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -83.81 -37.29 22.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.201 -1.363 . . . . 0.8 111.502 -175.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -66.13 -31.87 72.99 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.798 -0.815 . . . . 1.73 108.798 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.11 -15.29 59.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.042 -1.435 . . . . 1.02 111.908 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.4 mt -92.28 -33.95 14.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.721 0.296 . . . . 0.93 110.688 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.518 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 70.3 mtm -70.19 142.56 90.09 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 1.15 111.191 -176.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -70.65 149.13 60.75 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.65 2.234 . . . . 0.9 111.906 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -44.37 -49.39 8.98 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.866 3.044 . . . . 0.96 113.599 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.463 ' O ' HD21 ' A' ' 66' ' ' LEU . 46.5 mt-10 -59.05 -43.25 91.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.688 0.28 . . . . 1.83 111.703 -176.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.83 -7.12 49.25 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.997 0.427 . . . . 0.82 111.227 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.518 ' HD2' ' O ' ' A' ' 14' ' ' MET . 62.2 mtp180 -101.01 -32.54 10.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.85 -0.614 . . . . 2.16 110.189 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -49.81 -46.31 50.91 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.854 -0.612 . . . . 1.06 111.392 177.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.676 ' O ' HD23 ' A' ' 25' ' ' LEU . 58.0 t80 -56.24 -56.59 19.08 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.965 -0.561 . . . . 0.65 111.526 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -78.66 -7.52 57.75 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.609 1.095 . . . . 1.13 111.984 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -70.97 -32.86 69.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.93 0.395 . . . . 2.06 110.152 164.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -82.67 -49.6 9.62 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.737 -0.665 . . . . 1.84 112.244 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 21' ' ' PHE . 2.9 mm? -52.26 134.15 33.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.382 0.61 . . . . 1.05 111.005 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 25.1 t -130.01 -69.55 0.67 Allowed 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.444 -0.798 . . . . 1.78 111.289 -174.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -141.24 -78.07 0.28 Allowed 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.193 0.442 . . . . 2.39 112.193 -172.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.405 ' O ' ' HB ' ' A' ' 31' ' ' THR . . . -62.75 -30.84 78.19 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.93 112.594 -174.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.654 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -66.9 -51.69 52.3 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.636 -0.282 . . . . 2.25 110.898 176.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HE3' ' C ' ' A' ' 25' ' ' LEU . 87.7 mttt -56.87 -27.31 60.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.116 0.484 . . . . 1.31 110.886 176.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 28' ' ' GLY . 45.3 m -65.2 -26.92 68.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.496 -0.774 . . . . 0.8 110.717 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.654 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.9 p -98.27 -23.9 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.853 0 C-N-CA 120.64 -0.424 . . . . 0.85 110.808 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.402 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -54.07 -50.36 66.94 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.74 -0.209 . . . . 0.98 111.14 171.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 0.0 OUTLIER -64.97 -25.48 67.89 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.726 0.298 . . . . 2.41 111.712 -177.204 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' N ' ' HD3' ' A' ' 34' ' ' LYS . 9.0 mm-40 -68.97 -39.12 79.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.348 -0.387 . . . . 1.96 110.281 175.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.75 -50.66 42.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.936 -0.574 . . . . 0.98 110.379 178.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.406 ' CE2' ' CD2' ' A' ' 100' ' ' TYR . 20.4 m-85 -54.6 -46.45 73.8 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 114.066 1.135 . . . . 0.83 114.066 177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 52.9 mtmt -84.6 7.86 18.74 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.662 -0.815 . . . . 2.18 111.201 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.27 12.24 32.03 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.087 -0.709 . . . . 1.56 109.087 171.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -97.27 -152.26 28.45 Favored Glycine 0 N--CA 1.446 -0.683 0 CA-C-N 115.209 -0.905 . . . . 1.54 111.242 175.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -70.74 153.65 95.54 Favored 'Cis proline' 0 C--N 1.344 0.3 0 CA-C-N 119.088 1.444 . . . . 1.68 112.655 -0.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.574 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 98.6 m-85 -103.83 140.65 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.86 -0.609 . . . . 1.28 110.095 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -76.58 -15.73 59.78 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.464 -0.789 . . . . 3.51 110.239 -179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -153.94 148.08 25.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.713 -0.676 . . . . 1.52 110.327 -177.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.8 t -68.91 -18.66 64.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.074 -0.512 . . . . 1.18 111.525 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -57.12 -46.35 82.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.902 0.382 . . . . 2.24 110.739 176.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.574 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.2 OUTLIER -63.6 -29.74 70.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.038 -0.528 . . . . 2.26 111.367 179.796 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.0 t -72.43 -42.1 65.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.722 -0.473 . . . . 1.19 109.722 178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.84 -46.36 88.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.776 -0.647 . . . . 0.55 110.205 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.42 -49.51 67.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.182 -0.917 . . . . 0.57 111.673 176.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.14 -40.79 82.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.183 0.516 . . . . 0.5 110.788 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.402 HD21 HD13 ' A' ' 33' ' ' LEU . 48.1 mt -69.73 -37.06 76.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 0.45 111.086 -179.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -62.91 -38.74 92.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.915 0.388 . . . . 1.22 111.67 177.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -74.17 -35.68 64.02 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.154 0.502 . . . . 3.05 110.988 -178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.623 ' HB3' HG21 ' A' ' 32' ' ' VAL . 22.6 mmtt -77.41 -46.49 22.54 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.827 -0.624 . . . . 1.48 111.852 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.47 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 68.6 m -146.11 97.01 4.52 Favored Pre-proline 0 C--N 1.315 -0.918 0 N-CA-C 110.108 -0.33 . . . . 1.16 110.108 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 56' ' ' SER . 5.7 Cg_endo -47.5 -62.94 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.855 3.036 . . . . 0.58 113.553 -167.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 11.2 pt-20 -67.14 -25.55 66.24 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.162 -0.926 . . . . 2.45 111.749 -177.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 59' ' ' LEU . 2.0 tm? -74.29 -41.67 60.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.529 -0.915 . . . . 1.42 108.529 -177.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -70.9 -23.71 77.75 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 114.596 -1.183 . . . . 0.37 111.639 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.28 -32.51 71.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.804 0.335 . . . . 0.48 110.454 173.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 67.9 mttm -64.93 -49.85 68.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.138 -0.483 . . . . 2.17 110.766 178.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.9 p -65.27 -29.9 48.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.925 0.393 . . . . 1.12 110.348 178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.79 -61.66 2.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.013 -0.539 . . . . 1.7 111.002 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 69' ' ' MET . 13.9 mptt -59.78 -37.07 78.06 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 121.11 0.481 . . . . 3.96 110.596 -174.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.3 tm? -64.61 -43.7 92.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.123 -0.944 . . . . 1.5 110.278 179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 2.5 t60 -78.82 -32.97 46.47 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.321 -0.622 . . . . 2.34 109.321 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.47 -42.51 98.59 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.12 -0.946 . . . . 0.4 111.832 178.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.428 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 61.5 mtm -59.83 -51.08 71.27 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.411 0.624 . . . . 0.72 110.06 176.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 66' ' ' LEU . 97.1 t -57.02 -43.58 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 CA-C-N 114.786 -1.097 . . . . 0.79 110.687 178.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' HIS . 27.4 mmmt -61.12 -38.84 87.8 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.92 -0.582 . . . . 1.47 111.386 177.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 20.4 m -63.17 -37.22 86.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.26 0.553 . . . . 1.26 110.801 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -72.35 -43.37 64.15 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 1.54 110.416 177.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' ' HE2' ' A' ' 82' ' ' LYS . 72.0 mt -67.99 -22.5 27.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.477 0.656 . . . . 0.34 110.245 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.04 -36.25 72.27 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.931 0.872 . . . . 0.35 109.851 176.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.01 -2.08 55.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.301 -1.318 . . . . 0.49 110.27 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' HG ' ' HB3' ' A' ' 81' ' ' ALA . 8.5 tp -92.01 137.03 32.7 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.526 -0.761 . . . . 0.71 109.605 -176.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.39 156.66 52.21 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.755 -0.736 . . . . 0.76 111.964 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -44.29 -41.43 13.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.86 3.04 . . . . 1.56 114.235 -175.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -67.43 -50.22 60.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.71 0.291 . . . . 2.52 110.76 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.444 ' HB3' ' HG ' ' A' ' 77' ' ' LEU . . . -76.24 -31.35 58.31 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.258 -0.577 . . . . 0.36 110.297 -176.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 74' ' ' ILE . 40.7 ttmt -58.35 -45.58 87.92 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.475 -0.784 . . . . 2.04 111.187 176.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.12 -40.85 96.17 Favored Glycine 0 C--N 1.332 0.35 0 C-N-CA 120.899 -0.667 . . . . 0.41 112.177 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 18.5 t80 -73.26 -44.13 59.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.99 -0.105 . . . . 1.65 111.278 177.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.458 ' O ' HD13 ' A' ' 89' ' ' ILE . . . -55.51 -44.92 77.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.95 0.405 . . . . 0.41 111.657 -175.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.554 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 40.6 mt-10 -71.19 -22.26 62.04 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.544 -0.462 . . . . 1.96 110.846 -179.315 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm -79.5 -40.3 30.02 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.619 -0.264 . . . . 2.12 111.249 177.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.3 p -61.78 -27.04 68.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.061 0.457 . . . . 0.57 110.3 176.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 85' ' ' ALA . 1.7 mp -74.34 -50.51 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-N 115.918 -0.583 . . . . 1.09 110.132 171.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 42.1 mt-10 -58.23 -53.64 55.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.191 0.441 . . . . 2.82 112.191 -177.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.8 mt -62.72 -45.85 97.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.276 -0.42 . . . . 0.51 111.218 -174.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.523 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.63 -40.88 84.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.64 110.872 179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -63.5 -31.05 72.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.87 -0.605 . . . . 4.42 110.673 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.14 -36.15 89.82 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.782 -0.723 . . . . 0.66 111.896 178.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.436 HG13 ' CB ' ' A' ' 113' ' ' SER . 43.9 mm -67.66 -50.27 62.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.058 0.456 . . . . 0.55 110.42 178.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 39.4 pttt -82.12 0.19 41.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.159 -0.473 . . . . 2.7 111.646 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -74.52 -27.99 60.78 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.127 -0.694 . . . . 0.63 109.127 164.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.503 ' HA ' ' HG1' ' A' ' 101' ' ' THR . 66.6 mtp180 -86.69 -7.61 58.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.679 -0.691 . . . . 3.1 109.579 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -81.89 -41.36 21.05 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.349 -0.611 . . . . 0.97 109.349 167.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 32.5 m-85 -63.39 -50.11 71.16 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 121.201 0.524 . . . . 1.48 110.981 178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.503 ' HG1' ' HA ' ' A' ' 98' ' ' ARG . 17.5 p -66.78 -14.43 62.6 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.321 0.86 . . . . 0.87 113.321 -173.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 94.13 3.43 63.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.689 -0.767 . . . . 1.16 113.184 -176.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.437 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 37.0 m-80 -98.51 68.31 1.83 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.2 -0.296 . . . . 1.83 110.2 -178.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -52.31 119.65 15.47 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.709 -0.678 . . . . 1.75 112.318 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.22 163.38 38.86 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 123.589 2.859 . . . . 0.53 112.722 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 67.3 p -85.77 173.52 9.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.116 -0.493 . . . . 1.48 109.865 174.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -66.59 -27.83 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.19 -0.67 . . . . 2.88 109.19 175.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.43 -40.23 93.66 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.286 -0.87 . . . . 2.24 110.782 177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -59.04 -44.71 91.8 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.876 0.37 . . . . 1.73 110.588 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.561 ' O ' HG13 ' A' ' 114' ' ' VAL . 11.0 mp -67.66 -46.13 73.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.885 -0.598 . . . . 0.82 110.835 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.435 ' O ' HG22 ' A' ' 114' ' ' VAL . 61.8 mtpt -55.77 -45.86 78.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.261 0.553 . . . . 1.74 110.101 177.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 115' ' ' LYS . . . -62.07 -43.5 98.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.441 -0.799 . . . . 0.47 111.692 178.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.436 ' CB ' HG13 ' A' ' 95' ' ' ILE . 57.9 p -64.92 -36.2 83.6 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.002 0.371 . . . . 1.34 112.002 -178.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.797 HG23 ' HB2' ' A' ' 152' ' ' ALA . 4.0 m -78.62 -25.12 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 109.024 -0.732 . . . . 0.65 109.024 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 112' ' ' ALA . 45.5 mttm -61.53 -45.81 92.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.221 -0.899 . . . . 1.72 111.408 176.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.625 ' O ' HD13 ' A' ' 120' ' ' LEU . 22.3 mm-40 -71.01 -38.7 72.63 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.582 -0.447 . . . . 2.27 110.457 -174.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.523 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.9 m -62.85 -38.5 82.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 120.483 -0.487 . . . . 0.81 110.265 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.615 HD13 ' HA ' ' A' ' 149' ' ' ALA . 41.2 mt -78.49 -26.68 46.05 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 122.079 -0.388 . . . . 1.21 111.358 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 8.4 ttmt -61.98 -48.54 79.88 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.525 -0.917 . . . . 0.95 108.525 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -65.78 -43.82 87.62 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.072 -1.422 . . . . 1.06 111.667 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.472 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 47.7 t80 -72.03 -37.52 69.73 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 120.315 -0.554 . . . . 1.54 111.291 -170.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' A' ' 118' ' ' LEU . 5.8 mptp? -59.75 -31.97 70.14 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.47 . . . . 1.98 111.052 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -83.44 -5.68 59.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.593 -0.731 . . . . 0.7 112.608 -174.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -77.39 156.69 31.02 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.048 -0.661 . . . . 0.5 110.389 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.7 t -67.23 152.05 46.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.639 -0.504 . . . . 1.18 109.639 174.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -54.72 -42.42 71.5 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.814 0.34 . . . . 2.21 111.254 -175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.04 -30.39 71.46 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.013 -0.54 . . . . 0.42 111.044 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.92 -37.46 50.49 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 111.217 -0.753 . . . . 0.31 111.217 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -63.08 -45.63 91.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.195 0.521 . . . . 1.32 109.986 176.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.49 -36.59 84.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.426 -0.807 . . . . 0.42 111.41 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 134' ' ' LYS . 24.7 t70 -73.84 -30.63 62.79 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.292 0.567 . . . . 0.55 109.774 -177.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -64.52 -26.07 68.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.008 -0.542 . . . . 0.39 110.228 172.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.46 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -73.96 -14.8 79.99 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 114.243 0.457 . . . . 0.27 114.243 -175.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.517 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 0.5 OUTLIER -95.53 -34.18 12.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 117.518 0.659 . . . . 2.43 111.408 -179.283 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -89.64 -28.73 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.768 -0.651 . . . . 1.83 110.695 -179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -128.9 72.96 81.74 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.296 -0.411 . . . . 0.69 110.168 172.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -61.2 -44.76 22.05 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.832 2.355 . . . . 0.63 112.922 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.527 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 34.8 t80 -66.87 -35.6 80.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 2.31 111.263 -174.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 56.9 mt -74.01 -44.06 55.82 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.614 -0.434 . . . . 1.02 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.46 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -61.15 -32.72 72.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.409 0.623 . . . . 0.35 110.065 176.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 64.2 tttm -55.18 -70.84 0.09 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.926 -1.034 . . . . 2.58 110.963 171.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.487 HG13 ' O ' ' A' ' 138' ' ' PHE . 3.9 m -60.37 -30.29 46.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 112.966 0.728 . . . . 0.5 112.966 -175.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.28 -54.4 14.87 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.248 -0.581 . . . . 0.62 110.657 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -79.22 -19.19 51.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.083 -0.508 . . . . 2.58 112.088 -172.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 17.1 t -85.48 3.45 40.24 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.992 0.425 . . . . 1.32 110.58 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 149' ' ' ALA . . . 75.54 16.83 80.39 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.803 -0.713 . . . . 1.09 112.804 177.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -79.45 -62.38 1.71 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.836 0.351 . . . . 1.98 110.112 -178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -70.75 -37.14 73.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.094 -0.503 . . . . 0.34 110.006 176.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.615 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -54.56 -37.45 65.47 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.284 -0.871 . . . . 0.51 111.82 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 150' ' ' LYS . 45.3 tptt -82.8 -23.79 33.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.902 0.382 . . . . 2.82 110.697 -177.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.42 ' HD2' HG21 ' A' ' 114' ' ' VAL . 50.2 t80 -72.48 -29.16 63.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.11 -0.496 . . . . 0.49 109.823 174.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.797 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -86.62 -35.08 19.61 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.903 -0.589 . . . . 0.59 110.826 176.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 117.82 -36.75 3.54 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.533 -1.027 . . . . 1.62 110.533 -172.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 70.76 158.13 0.18 Allowed 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.927 0.891 . . . . 4.12 111.513 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 41.3 m-80 . . . . . 0 C--O 1.245 0.829 0 CA-C-O 118.828 -0.606 . . . . 4.01 109.443 -176.994 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 86.6 mmm . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.514 0.197 . . . . 23.59 111.451 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -77.94 65.46 3.24 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.949 -0.644 . . . . 22.47 112.268 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.6 m -96.25 118.51 32.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.989 0.423 . . . . 21.51 110.467 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 27.1 m -69.53 133.34 47.55 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.934 -0.576 . . . . 20.19 109.812 177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.36 -42.32 75.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.552 . . . . 21.42 110.788 -177.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -162.65 81.38 0.51 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.886 0.374 . . . . 18.2 110.473 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -127.87 94.84 4.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.304 -0.407 . . . . 16.06 110.836 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 40.5 p-80 -162.23 134.3 5.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.958 -0.756 . . . . 13.27 108.958 172.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 -112.93 -84.46 0.59 Allowed 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.785 -0.366 . . . . 12.33 111.093 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 38.0 m-70 61.6 174.59 0.12 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.889 0.376 . . . . 11.33 111.083 -173.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.8 m 58.91 45.4 15.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.943 -0.571 . . . . 7.95 110.826 179.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 66.3 m -74.28 94.15 2.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.167 0.508 . . . . 7.36 111.125 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 95.71 -172.74 30.2 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.954 -0.641 . . . . 4.57 111.727 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -82.21 78.77 8.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.288 0.566 . . . . 4.52 110.201 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.759 ' SD ' ' HD2' ' A' ' 30' ' ' LYS . 44.6 tpp -86.9 107.14 18.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.448 -0.796 . . . . 2.0 110.526 -179.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 24.1 p90 -78.3 147.27 34.33 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 1.47 110.855 179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -105.48 136.12 45.63 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.376 -0.601 . . . . 3.15 109.376 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -65.23 -35.27 80.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.85 0.357 . . . . 2.35 110.737 -177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -73.1 -5.75 41.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.451 -0.34 . . . . 4.16 111.753 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -87.92 -10.93 49.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.401 0.619 . . . . 2.57 109.848 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 68.1 mt -79.31 134.69 58.42 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 108.499 -0.926 . . . . 0.69 108.499 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -41.78 113.58 0.29 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.184 2.589 . . . . 0.6 112.123 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.74 -17.99 65.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.723 -0.671 . . . . 0.57 111.768 -172.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 7.4 m-20 -65.27 -31.21 72.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.936 0.874 . . . . 1.37 109.426 178.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 75.0 t80 -85.06 -28.89 25.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.036 -1.438 . . . . 0.8 110.313 -178.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.495 ' HA ' ' HG2' ' A' ' 14' ' ' MET . 58.7 mtp180 -72.02 -25.05 61.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.84 0.829 . . . . 1.73 108.849 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -71.53 -18.99 62.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.172 -1.376 . . . . 1.02 110.661 174.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 9' ' ' ASP . 72.1 mt -91.39 -48.48 6.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 0.93 111.124 -179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.495 ' HG2' ' HA ' ' A' ' 11' ' ' ARG . 17.5 ptp -63.23 133.38 95.43 Favored Pre-proline 0 C--O 1.233 0.228 0 CA-C-O 120.979 0.419 . . . . 1.15 109.994 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.43 ' HD3' HD21 ' A' ' 139' ' ' LEU . 65.8 Cg_endo -74.26 163.81 35.61 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.602 2.201 . . . . 0.9 112.385 -175.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -43.83 -41.74 11.88 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.93 2.42 . . . . 0.96 112.697 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -49.7 -34.5 18.87 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.438 -0.801 . . . . 1.83 112.122 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.53 -19.25 19.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.717 0.294 . . . . 0.82 111.25 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.455 ' HG2' ' SD ' ' A' ' 14' ' ' MET . 19.0 mtm180 -88.46 -42.48 12.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.382 -0.372 . . . . 2.16 111.393 -176.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.54 -40.74 60.25 Favored 'General case' 0 C--N 1.331 -0.202 0 O-C-N 123.242 0.339 . . . . 1.06 111.832 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.609 ' O ' HD23 ' A' ' 25' ' ' LEU . 32.5 t80 -61.34 -58.97 6.07 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 119.005 -0.522 . . . . 0.65 111.332 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.418 HD11 ' HE1' ' A' ' 100' ' ' TYR . 32.5 mt -73.41 -11.92 60.64 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 119.814 1.188 . . . . 1.13 112.192 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.86 -39.29 83.79 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.622 -0.51 . . . . 2.06 109.622 164.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -69.96 -50.43 41.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.866 -0.607 . . . . 1.84 111.109 178.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.609 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.5 mm? -59.32 141.97 53.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.31 0.576 . . . . 1.05 111.289 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.4 p -141.26 -83.03 0.21 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.491 -0.777 . . . . 1.78 110.456 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.93 158.73 43.8 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.999 -0.741 . . . . 2.39 108.999 176.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.52 -51.4 3.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.894 -0.67 . . . . 0.93 112.833 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.65 ' O ' HG12 ' A' ' 32' ' ' VAL . 7.8 m-20 -68.75 -43.89 74.87 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.787 -0.243 . . . . 2.25 111.14 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.759 ' HD2' ' SD ' ' A' ' 0' ' ' MET . 86.0 mttt -61.47 -20.03 62.69 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.0 0.429 . . . . 1.31 111.031 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.3 m -63.74 -39.98 95.61 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.754 -0.657 . . . . 0.8 110.975 177.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.7 p -80.85 -27.04 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 116.186 -0.461 . . . . 0.85 110.34 -176.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.572 ' O ' ' HD1' ' A' ' 37' ' ' PHE . 4.4 mm? -54.49 -56.41 19.11 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.279 -0.419 . . . . 0.98 111.329 173.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -60.93 -25.23 66.63 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.921 0.341 . . . . 2.41 111.921 -175.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -74.19 -15.4 61.01 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.969 0.414 . . . . 1.96 111.339 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 82.6 t -90.38 -48.1 14.36 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.575 0.702 . . . . 0.98 109.317 173.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.572 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 52.6 m-85 -55.1 -45.09 75.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.637 -1.165 . . . . 0.83 114.018 176.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -85.12 14.15 5.41 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 119.952 -0.699 . . . . 2.18 111.557 -176.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.51 -77.25 0.59 Allowed 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.556 -0.747 . . . . 1.56 109.846 173.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.508 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 45.82 -150.72 1.33 Allowed Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.795 -0.716 . . . . 1.54 112.684 -174.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 12.3 Cg_endo -91.84 148.99 16.0 Favored 'Cis proline' 0 N--CA 1.454 -0.838 0 C-N-CA 124.096 -1.21 . . . . 1.68 111.06 -9.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.508 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 23.4 m-85 -116.79 122.13 43.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.457 0.646 . . . . 1.28 111.067 -171.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.592 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 6.9 ptpp? -88.39 -7.02 57.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.91 -1.041 . . . . 3.51 109.948 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.586 HD21 ' HG3' ' A' ' 47' ' ' GLU . 8.2 p30 -151.83 162.63 40.72 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.67 -0.696 . . . . 1.52 109.654 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 25.9 m -69.38 -32.66 71.84 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.392 -0.367 . . . . 1.18 111.19 -177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 46.3 mt-10 -59.59 -38.33 80.94 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.073 -0.512 . . . . 2.24 111.313 -176.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.592 ' OE1' ' HG2' ' A' ' 43' ' ' LYS . 34.0 mt-10 -57.87 -42.76 85.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.955 0.407 . . . . 2.26 111.403 177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -70.99 -37.48 72.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.141 -0.481 . . . . 1.19 110.148 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 45' ' ' THR . 69.9 mt -65.98 -42.65 92.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.088 -0.505 . . . . 0.55 110.093 178.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.02 75.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.339 -0.846 . . . . 0.57 111.025 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.49 90.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.871 -0.604 . . . . 0.5 110.396 178.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.552 HD21 HD13 ' A' ' 33' ' ' LEU . 24.9 mt -67.23 -40.76 86.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.135 -0.939 . . . . 0.45 111.174 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -61.51 -32.68 72.72 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.809 0.338 . . . . 1.22 111.004 177.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -77.27 -46.8 21.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.22 -0.445 . . . . 3.05 110.596 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.511 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 9.1 mmtt -68.52 -49.46 59.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.024 -0.535 . . . . 1.48 111.858 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 m -147.5 92.26 4.85 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 109.853 -0.425 . . . . 1.16 109.853 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -37.39 -56.75 0.8 Allowed 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 124.593 3.529 . . . . 0.58 114.096 -172.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.68 -28.89 69.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.409 -0.814 . . . . 2.45 112.148 -175.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 33.8 mt -72.63 -37.9 67.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.755 0.788 . . . . 1.42 109.022 -178.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -67.27 -36.41 89.6 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 114.526 -1.215 . . . . 0.37 111.229 174.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.595 ' O ' ' HD3' ' A' ' 65' ' ' LYS . . . -61.15 -41.19 96.31 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.348 -0.241 . . . . 0.48 110.348 174.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 59' ' ' LEU . 42.6 mmtm -50.89 -63.65 1.06 Allowed 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.261 0.553 . . . . 2.17 110.375 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.2 m -67.49 -27.69 39.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.048 -0.978 . . . . 1.12 111.747 -172.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.15 -45.85 79.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.826 0.346 . . . . 1.7 111.193 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.595 ' HD3' ' O ' ' A' ' 61' ' ' ALA . 1.0 OUTLIER -76.62 -34.88 58.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.742 0.782 . . . . 3.96 109.448 179.184 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.44 -48.11 68.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.593 -1.185 . . . . 1.5 112.047 -175.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -72.93 -25.92 61.21 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.842 -0.799 . . . . 2.34 108.842 -175.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.84 -35.3 80.28 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 114.68 -1.146 . . . . 0.4 111.225 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.4 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 36.4 mtm -62.48 -49.96 73.31 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.139 -0.689 . . . . 0.72 109.139 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.424 HG13 ' CZ ' ' A' ' 136' ' ' PHE . 67.4 t -54.22 -48.81 66.15 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-N 114.707 -1.133 . . . . 0.79 110.268 176.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.1 mmmt -63.6 -43.08 97.98 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 115.485 -0.78 . . . . 1.47 112.403 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.5 m -64.88 -30.53 71.53 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.855 0.359 . . . . 1.26 111.303 -178.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 69' ' ' MET . 52.5 mtmt -77.79 -36.26 50.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.428 -0.351 . . . . 1.54 110.232 176.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.7 mt -71.89 -24.83 23.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.505 0.669 . . . . 0.34 110.319 174.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.26 -30.92 70.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.804 0.811 . . . . 0.35 109.798 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.47 -0.63 57.33 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.562 -1.199 . . . . 0.49 110.709 -179.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.3 tp -94.79 135.48 36.23 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.851 -0.613 . . . . 0.71 109.944 -178.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.44 144.43 48.44 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.72 -0.752 . . . . 0.76 111.929 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -33.8 -43.3 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 125.067 3.845 . . . . 1.56 115.199 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -64.76 -52.73 55.41 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.941 0.4 . . . . 2.52 110.591 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.5 -31.55 53.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.41 0.624 . . . . 0.36 109.946 -177.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -57.84 -46.26 85.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.772 -1.104 . . . . 2.04 111.118 176.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.91 -40.2 98.54 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.648 -0.787 . . . . 0.41 111.574 177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -65.3 -46.57 79.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.603 -0.299 . . . . 1.65 110.804 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.35 -46.0 83.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.039 0.447 . . . . 0.41 111.198 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -60.04 -38.42 82.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.801 -0.636 . . . . 1.96 111.3 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.443 ' HD2' HD11 ' A' ' 91' ' ' ILE . 4.3 tmtp? -77.61 -46.45 22.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.123 -0.231 . . . . 2.12 110.65 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 19.3 p -63.37 -43.05 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.753 0.311 . . . . 0.57 111.165 -176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -62.03 -40.36 87.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 1.09 110.354 176.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -66.76 -35.52 80.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.493 -0.321 . . . . 2.82 111.42 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.443 HD11 ' HD2' ' A' ' 87' ' ' LYS . 94.8 mt -63.87 -45.72 96.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.723 0.297 . . . . 0.51 110.513 177.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.683 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -64.95 -42.44 94.62 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.697 -0.482 . . . . 0.64 109.697 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -59.48 -34.06 72.09 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.556 -0.747 . . . . 4.42 111.265 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.69 -39.55 86.13 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.958 -0.639 . . . . 0.66 112.287 179.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.467 HD11 ' OG ' ' A' ' 113' ' ' SER . 29.6 mm -66.45 -49.67 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.166 0.508 . . . . 0.55 109.672 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.683 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.5 ptmm? -83.87 36.01 0.54 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.61 0.719 . . . . 2.7 110.114 175.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -122.1 -32.92 3.61 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.949 -1.023 . . . . 0.63 109.842 165.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -88.0 -3.48 58.9 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.137 -0.483 . . . . 3.1 110.315 178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CE2' ' HG2' ' A' ' 105' ' ' PRO . 28.2 m-85 -88.32 -31.23 19.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.16 0.505 . . . . 0.97 109.778 166.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.454 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 4.5 m-85 -66.74 -34.57 78.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.722 -0.672 . . . . 1.48 111.765 -176.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 p -73.63 -0.42 15.33 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.756 -0.657 . . . . 0.87 112.644 -174.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 90.86 9.48 64.03 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.688 -0.768 . . . . 1.16 111.945 -175.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -105.28 177.3 4.89 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.851 -0.426 . . . . 1.83 109.851 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 56.8 mt-10 -141.59 100.65 6.13 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.611 -0.268 . . . . 1.75 111.396 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.452 ' HG2' ' CE2' ' A' ' 99' ' ' TYR . 9.6 Cg_endo -56.96 132.83 54.07 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 121.987 1.791 . . . . 0.53 110.078 167.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.9 t -76.03 173.51 11.18 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.313 -0.555 . . . . 1.48 110.157 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 86.0 tttt -60.13 -33.12 71.71 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.767 -0.373 . . . . 2.88 110.366 -175.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -58.32 -40.87 83.2 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.819 -0.628 . . . . 2.24 110.864 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -59.02 -47.55 84.8 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.124 -0.489 . . . . 1.73 110.544 177.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.498 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.7 mp -65.4 -45.98 81.83 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.715 -0.675 . . . . 0.82 110.713 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 151' ' ' PHE . 59.9 mtpt -55.16 -51.32 66.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.03 0.443 . . . . 1.74 110.481 178.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.554 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -60.96 -41.26 96.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.543 -0.753 . . . . 0.47 111.2 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.467 ' OG ' HD11 ' A' ' 95' ' ' ILE . 50.4 m -65.13 -43.08 93.1 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.216 -0.447 . . . . 1.34 112.04 -178.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.517 HG23 ' HB2' ' A' ' 152' ' ' ALA . 10.2 m -76.15 -29.88 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.596 0.712 . . . . 0.65 109.646 -176.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 10.4 ptmt -72.47 -26.11 61.68 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.13 -0.941 . . . . 1.72 110.624 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.569 ' O ' HD13 ' A' ' 120' ' ' LEU . 4.8 tt0 -76.83 -33.7 57.93 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 109.262 -0.644 . . . . 2.27 109.262 174.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.471 ' HB ' ' O ' ' A' ' 114' ' ' VAL . 93.6 t -58.42 -47.72 87.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.424 0.63 . . . . 0.81 110.198 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.582 ' O ' ' HG3' ' A' ' 122' ' ' LYS . 7.7 mt -69.41 -26.14 64.48 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.62 -0.718 . . . . 1.21 110.37 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 34.3 ttpt -62.62 -43.99 97.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.677 -0.86 . . . . 0.95 108.677 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.569 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.77 -45.95 66.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 114.839 -1.073 . . . . 1.06 111.841 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -36.12 70.99 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 118.929 -1.108 . . . . 1.54 111.833 -168.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 118' ' ' LEU . 29.8 mttp -64.39 -30.3 71.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.057 0.456 . . . . 1.98 110.49 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -81.47 -6.38 58.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.727 -0.669 . . . . 0.7 112.352 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.6 mtm -77.37 158.38 30.13 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.224 -0.591 . . . . 0.5 110.317 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.5 m -65.15 152.11 44.4 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 110.338 -0.245 . . . . 1.18 110.338 173.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -57.18 -42.15 80.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.725 0.298 . . . . 2.21 111.181 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -64.2 -29.65 70.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.42 110.956 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -73.25 -38.66 53.66 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.942 -0.572 . . . . 0.31 111.932 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -61.51 -45.54 93.78 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.474 0.654 . . . . 1.32 109.514 176.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.35 -35.18 80.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.05 -0.977 . . . . 0.42 110.966 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -74.24 -34.35 63.62 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.047 -0.524 . . . . 0.55 109.669 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -63.06 -34.03 76.72 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.722 -0.672 . . . . 0.39 110.098 172.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.43 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -63.9 -22.3 66.4 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.94 -0.573 . . . . 0.27 113.318 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? -85.81 -19.38 30.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.946 0.403 . . . . 2.43 111.386 -178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -105.45 -37.2 6.9 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 1.83 110.991 -177.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.424 ' CZ ' HG13 ' A' ' 70' ' ' VAL . 77.8 m-85 -129.23 73.58 81.59 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.932 0.396 . . . . 0.69 110.059 175.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.47 -30.78 72.08 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.885 2.39 . . . . 0.63 112.388 -175.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.571 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 36.2 t80 -69.63 -39.53 77.09 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.439 . . . . 2.31 110.242 -178.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.465 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 71.0 mt -77.62 -44.14 29.2 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.301 -0.408 . . . . 1.02 110.75 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.43 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -57.29 -39.03 74.91 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.744 -0.465 . . . . 0.35 109.744 177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.571 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 78.2 tttt -45.62 -71.88 0.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.04 -0.982 . . . . 2.58 111.444 171.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.0 m -67.06 -25.24 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 115.489 -0.778 . . . . 0.5 112.706 -172.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.465 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 23.0 m-30 -75.03 -54.52 7.02 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 119.755 -0.778 . . . . 0.62 110.125 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -64.69 -31.3 72.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.93 -0.577 . . . . 2.58 111.777 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 15.7 m -84.9 0.19 51.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.794 0.33 . . . . 1.32 111.471 -177.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.97 79.06 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.774 -0.727 . . . . 1.09 112.648 178.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -69.43 -47.33 64.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.94 0.4 . . . . 1.98 110.102 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.95 -30.49 61.24 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.149 -0.478 . . . . 0.34 110.589 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.541 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -58.58 -39.55 80.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.51 111.725 -178.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -79.87 -29.54 40.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.78 -0.368 . . . . 2.82 110.8 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 111' ' ' LYS . 66.7 t80 -66.56 -33.01 74.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.177 0.513 . . . . 0.49 109.656 172.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.517 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -67.74 -25.59 65.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.349 -0.841 . . . . 0.59 111.03 177.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 88.68 15.15 60.23 Favored Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.558 -0.746 . . . . 1.62 112.013 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.442 ' HG2' ' HB3' ' A' ' 152' ' ' ALA . 6.3 pt-20 -115.83 165.87 12.6 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.98 -0.129 . . . . 4.12 110.72 -177.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 . . . . . 0 C--O 1.25 1.12 0 CA-C-O 119.262 -0.399 . . . . 4.01 111.409 168.823 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 97.4 mmm . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.905 0.383 . . . . 23.59 110.524 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 147.98 64.1 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.709 -0.757 . . . . 22.47 112.241 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 19.5 p -71.26 144.11 50.15 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.555 0.217 . . . . 21.51 110.93 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 64.9 p 51.74 41.1 28.84 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.509 0.724 . . . . 20.19 111.94 178.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -70.67 142.07 51.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.212 -0.449 . . . . 21.42 110.21 178.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -129.56 148.02 51.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.058 0.456 . . . . 18.2 111.667 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 56.1 p-80 -122.69 45.65 2.34 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.832 0.825 . . . . 16.06 108.994 175.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 19.7 t-80 -78.44 9.45 3.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.908 -1.042 . . . . 13.27 111.236 -172.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -84.95 -12.45 53.3 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.874 -0.417 . . . . 12.33 109.874 177.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 67.26 174.03 0.26 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.287 -0.87 . . . . 11.33 111.179 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.5 t 55.91 57.9 4.82 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.465 0.65 . . . . 7.95 110.38 178.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 10.2 p -78.65 132.06 36.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.861 -0.609 . . . . 7.36 111.032 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 100.4 -122.61 7.65 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.964 -0.636 . . . . 4.57 111.815 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -134.17 98.25 4.07 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.055 0.455 . . . . 4.52 110.297 177.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 17.7 ttm -104.76 77.41 1.35 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.959 -0.564 . . . . 2.0 110.175 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -68.94 156.33 38.73 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.708 -0.678 . . . . 1.47 109.821 -179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -105.7 149.45 26.37 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 109.968 -0.382 . . . . 3.15 109.968 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -54.47 -45.55 73.2 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.921 0.391 . . . . 2.35 111.233 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.54 16.34 1.39 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.477 0.547 . . . . 4.16 112.477 -176.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -86.12 -8.56 57.78 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 108.647 -0.872 . . . . 2.57 108.647 171.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 55.8 mt -85.62 129.27 55.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.947 -1.024 . . . . 0.69 109.0 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -42.34 114.77 0.42 Allowed 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.311 2.674 . . . . 0.6 112.442 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.61 -23.96 65.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.82 -0.627 . . . . 0.57 111.928 -174.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -65.32 -35.94 82.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.724 0.773 . . . . 1.37 110.022 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -82.16 -20.24 38.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.655 -1.157 . . . . 0.8 110.945 -178.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.0 mtp180 -72.35 -20.24 61.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.266 -0.642 . . . . 1.73 109.266 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.4 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 6.4 t70 -74.71 -23.69 58.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.844 -1.071 . . . . 1.02 109.745 174.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.42 HD11 ' HG2' ' A' ' 147' ' ' LYS . 10.0 mp -83.6 -44.28 14.76 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 114.998 -1.001 . . . . 0.93 110.33 173.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.505 ' SD ' ' HE3' ' A' ' 96' ' ' LYS . 46.4 ttp -68.14 128.7 93.22 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.111 -0.949 . . . . 1.15 111.443 -173.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 37.8 Cg_endo -64.89 149.61 89.3 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.142 2.561 . . . . 0.9 112.808 -175.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 71.9 Cg_exo -51.89 -27.95 29.58 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 124.096 3.197 . . . . 0.96 113.04 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -64.48 -57.42 9.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.26 0.553 . . . . 1.83 109.584 178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 -28.33 69.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.797 -0.638 . . . . 0.82 110.577 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -68.89 -40.72 79.03 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 115.8 -0.636 . . . . 2.16 110.758 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.67 -53.1 60.7 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.378 0.511 . . . . 1.06 112.378 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 69.1 t80 -57.21 -41.78 80.1 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 112.458 0.54 . . . . 0.65 112.458 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 25' ' ' LEU . 91.6 mt -88.85 -13.79 38.41 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 118.955 0.798 . . . . 1.13 111.402 177.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.45 -42.39 92.4 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.241 -0.652 . . . . 2.06 109.241 164.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.4 m-80 -68.1 -53.24 26.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.331 -0.849 . . . . 1.84 111.26 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.448 HD22 ' CB ' ' A' ' 29' ' ' ASP . 14.0 mt -56.17 129.91 42.08 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 121.545 0.688 . . . . 1.05 111.12 -177.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.5 m -143.47 -83.43 0.16 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.797 -1.092 . . . . 1.78 110.926 -175.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -112.4 142.87 44.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.522 -0.308 . . . . 2.39 110.651 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.81 -45.1 3.23 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.946 -0.645 . . . . 0.93 112.959 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.561 ' O ' HG12 ' A' ' 32' ' ' VAL . 5.2 m-20 -57.02 -47.32 81.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 2.25 110.696 -177.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.1 mmtm -57.08 -31.21 65.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.833 -0.621 . . . . 1.31 111.35 -174.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.7 m -67.8 -32.05 72.34 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.914 -0.585 . . . . 0.8 111.473 -178.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.561 HG12 ' O ' ' A' ' 29' ' ' ASP . 4.7 p -95.18 -28.05 4.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.048 -0.523 . . . . 0.85 111.722 -172.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.464 HD12 ' HE2' ' A' ' 37' ' ' PHE . 4.0 mm? -55.8 -45.95 78.13 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 111.707 0.262 . . . . 0.98 111.707 175.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -62.15 -30.44 71.05 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.66 0.266 . . . . 2.41 111.303 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -69.51 -37.06 77.01 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.331 -0.395 . . . . 1.96 110.611 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 86.8 t -71.97 -51.88 28.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.5 0.666 . . . . 0.98 110.233 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.675 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 24.0 m-85 -59.93 -41.47 91.84 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 115.068 1.507 . . . . 0.83 115.068 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -80.25 2.18 25.53 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.628 -0.829 . . . . 2.18 111.293 -178.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -98.07 -80.35 0.45 Allowed 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.708 -0.678 . . . . 1.56 109.623 172.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.48 ' HA2' ' CZ ' ' A' ' 42' ' ' TYR . . . 47.44 -157.98 0.63 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 120.761 -0.733 . . . . 1.54 112.96 -172.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -93.88 153.29 14.77 Favored 'Cis proline' 0 N--CA 1.453 -0.865 0 C-N-CA 124.042 -1.232 . . . . 1.68 111.49 -7.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.48 ' CZ ' ' HA2' ' A' ' 40' ' ' GLY . 25.7 m-85 -117.41 132.22 56.61 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.032 -0.531 . . . . 1.28 110.864 -173.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 47' ' ' GLU . 22.2 pttp -87.91 -12.71 43.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.481 -0.781 . . . . 3.51 109.907 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.552 HD21 ' HG3' ' A' ' 47' ' ' GLU . 0.2 OUTLIER -159.84 151.79 20.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.617 -0.719 . . . . 1.52 109.532 -179.308 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.8 m -60.1 -22.02 62.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.846 -0.615 . . . . 1.18 112.037 -174.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -58.02 -40.24 80.33 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.816 0.341 . . . . 2.24 110.801 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' HG3' HD21 ' A' ' 44' ' ' ASN . 46.3 mt-10 -64.77 -31.51 72.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 2.26 111.086 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.3 t -75.61 -37.63 59.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.234 -0.439 . . . . 1.19 109.831 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 79.3 mt -65.11 -42.89 95.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.987 -0.552 . . . . 0.55 109.655 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.06 -49.28 76.31 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.047 -0.979 . . . . 0.57 111.361 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.49 -41.85 95.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.848 -0.614 . . . . 0.5 110.669 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.28 -35.41 76.02 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 115.443 -0.799 . . . . 0.45 111.43 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -65.39 -36.61 84.48 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.028 0.442 . . . . 1.22 110.814 175.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -66.75 -50.15 63.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.709 . . . . 3.05 110.363 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HB3' HG21 ' A' ' 32' ' ' VAL . 43.0 mmtt -66.55 -55.34 15.91 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.536 -0.756 . . . . 1.48 111.915 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.6 t -139.92 95.47 8.62 Favored Pre-proline 0 C--N 1.316 -0.886 0 N-CA-C 110.199 -0.297 . . . . 1.16 110.199 -175.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -41.16 -58.94 0.9 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.922 3.081 . . . . 0.58 113.424 -171.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -62.35 -29.49 70.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.231 -0.895 . . . . 2.45 112.064 -179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 tt -71.83 -40.6 68.99 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.28 -1.007 . . . . 1.42 108.28 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -61.99 -31.39 78.42 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-N 114.555 -1.202 . . . . 0.37 111.683 175.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.12 -43.08 68.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 110.28 -0.267 . . . . 0.48 110.28 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -58.68 -45.16 90.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.255 -0.43 . . . . 2.17 111.323 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.4 p -72.41 -33.3 45.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.695 0.284 . . . . 1.12 111.121 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -69.03 -52.72 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.657 -0.247 . . . . 1.7 111.152 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -59.52 -36.49 76.22 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.43 0.633 . . . . 3.96 110.153 -176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.461 HD13 ' C ' ' A' ' 66' ' ' LEU . 2.4 tm? -66.44 -45.95 78.1 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.896 -1.047 . . . . 1.5 110.461 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -77.0 -27.62 54.73 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.357 -0.609 . . . . 2.34 109.357 -171.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.23 -41.91 96.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.223 -0.899 . . . . 0.4 111.461 175.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 49.6 mtm -59.37 -51.3 70.49 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.712 0.768 . . . . 0.72 109.32 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 76.6 t -52.41 -48.32 45.7 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 CA-C-N 114.121 -1.4 . . . . 0.79 110.474 176.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 9.5 mmmm -61.6 -41.15 97.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.422 -0.808 . . . . 1.47 111.814 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 22.9 t -58.7 -40.68 84.32 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.093 0.473 . . . . 1.26 110.787 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.518 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 61.8 mttm -74.01 -41.69 61.47 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.905 -0.588 . . . . 1.54 110.691 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.457 HD11 HD12 ' A' ' 89' ' ' ILE . 64.2 mt -68.2 -24.5 30.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.379 0.609 . . . . 0.34 110.662 177.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.23 -39.66 71.56 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.667 -0.697 . . . . 0.35 109.969 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.83 -46.52 62.58 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-N 114.939 -1.028 . . . . 0.49 109.973 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 135' ' ' GLN . 7.1 tp -40.62 132.68 2.12 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 114.858 -1.064 . . . . 0.71 112.723 176.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.06 159.71 49.34 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.562 -0.745 . . . . 0.76 112.306 178.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -46.83 -41.12 25.32 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 123.795 2.997 . . . . 1.56 113.722 -175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.4 -53.81 46.51 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.266 0.555 . . . . 2.52 110.393 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.553 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -78.02 -29.13 49.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.731 -0.668 . . . . 0.36 111.099 -173.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 25.8 ttpp -58.01 -42.52 85.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.722 -0.672 . . . . 2.04 110.53 176.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.35 -42.53 98.9 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.732 -0.747 . . . . 0.41 111.676 178.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.458 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 27.6 t80 -65.94 -46.06 79.55 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.445 0.164 . . . . 1.65 110.962 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.26 -50.06 74.1 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.019 0.437 . . . . 0.41 111.363 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.93 -23.37 65.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.71 -0.677 . . . . 1.96 111.209 -176.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -85.93 -49.81 7.57 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.448 -0.342 . . . . 2.12 110.942 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 22.3 p -62.21 -40.71 97.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.327 -0.397 . . . . 0.57 111.272 -176.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.457 HD12 HD11 ' A' ' 74' ' ' ILE . 43.5 mt -62.11 -37.15 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-N 116.172 -0.467 . . . . 1.09 111.322 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -69.59 -36.71 76.48 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.768 -0.373 . . . . 2.82 110.717 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 71.3 mt -62.11 -48.85 86.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.325 0.584 . . . . 0.51 109.801 175.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.8 68.02 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.592 -0.731 . . . . 0.64 111.1 179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 19.8 tpt180 -63.2 -41.41 99.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.83 -0.623 . . . . 4.42 110.133 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -67.45 -32.45 79.17 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.059 -0.591 . . . . 0.66 112.409 -177.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.0 mm -61.13 -43.32 96.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.0 0.429 . . . . 0.55 110.911 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.505 ' HE3' ' SD ' ' A' ' 14' ' ' MET . 3.5 mppt? -100.57 15.79 26.88 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.002 0.43 . . . . 2.7 110.529 178.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.675 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -93.34 -31.1 14.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.661 -0.699 . . . . 0.63 109.22 168.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.579 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 14.4 ptm180 -86.36 -1.49 57.58 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.842 -0.617 . . . . 3.1 109.941 173.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 4.3 m-85 -81.16 -26.76 35.81 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.037 -0.727 . . . . 0.97 109.037 164.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.596 ' CD2' ' HA ' ' A' ' 97' ' ' ALA . 24.0 m-85 -75.18 -48.89 21.37 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 121.404 0.621 . . . . 1.48 110.353 177.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.579 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 26.7 p -67.43 -15.6 63.76 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 0.87 112.906 -173.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 89.12 32.84 10.13 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.821 -0.704 . . . . 1.16 112.401 -176.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.66 61.71 1.4 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.705 -0.48 . . . . 1.83 109.705 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 104' ' ' GLU . 4.8 mp0 -45.5 119.67 4.53 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-N 115.205 -0.907 . . . . 1.75 111.999 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 35.8 Cg_endo -67.7 153.63 75.47 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.57 2.18 . . . . 0.53 111.629 175.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.432 HG23 ' H ' ' A' ' 108' ' ' ASP . 9.1 t -93.35 175.71 6.66 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.564 -0.902 . . . . 1.48 108.564 173.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 31.5 mtmt -62.71 -33.8 75.85 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.487 -0.485 . . . . 2.88 110.199 -175.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.432 ' H ' HG23 ' A' ' 106' ' ' THR . 3.4 m-20 -58.95 -38.65 79.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.455 -0.793 . . . . 2.24 111.197 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . 0.402 ' OD2' HG22 ' A' ' 106' ' ' THR . 37.1 m-20 -61.23 -44.16 97.71 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.023 -0.362 . . . . 1.73 110.023 178.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 114' ' ' VAL . 10.3 mp -67.59 -42.66 82.12 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.753 -0.658 . . . . 0.82 110.749 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 7.9 mtpm? -55.61 -48.19 75.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.258 0.551 . . . . 1.74 110.325 178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.29 -42.48 93.06 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.31 -0.859 . . . . 0.47 111.412 178.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HA ' ' A' ' 110' ' ' LEU . 79.5 p -64.79 -38.38 90.8 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.172 0.434 . . . . 1.34 112.172 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 152' ' ' ALA . 13.7 m -77.6 -23.65 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.847 0.832 . . . . 0.65 109.362 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -63.96 -41.14 97.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.778 -1.101 . . . . 1.72 110.987 179.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.44 ' O ' HD13 ' A' ' 120' ' ' LEU . 18.1 mm-40 -72.32 -33.71 67.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.583 -0.447 . . . . 2.27 110.608 -177.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.2 m -68.44 -34.41 65.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 C-N-CA 120.546 -0.462 . . . . 0.81 110.676 177.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 114' ' ' VAL . 3.1 mm? -70.7 -33.24 70.68 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 121.926 -0.484 . . . . 1.21 109.963 173.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 116' ' ' GLU . 37.4 ttpt -60.71 -46.02 91.97 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 109.146 -0.687 . . . . 0.95 109.146 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.9 mp -69.93 -47.82 60.89 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 114.963 -1.017 . . . . 1.06 111.804 175.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.458 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 70.3 t80 -70.18 -35.82 74.23 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 119.872 -0.731 . . . . 1.54 111.745 -167.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.413 ' HE3' HD12 ' A' ' 118' ' ' LEU . 75.4 mttt -67.59 -27.32 66.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.884 0.373 . . . . 1.98 111.088 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.96 -7.58 58.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.944 -0.571 . . . . 0.7 112.43 -176.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 41.2 mtm -75.68 159.25 31.34 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.433 -0.507 . . . . 0.5 111.047 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 m -63.43 143.33 57.91 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.359 -0.382 . . . . 1.18 110.66 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -56.32 -46.23 79.95 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.607 0.241 . . . . 2.21 111.425 -172.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.28 -33.51 74.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.004 0.431 . . . . 0.42 110.949 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.77 -35.77 58.43 Favored Glycine 0 N--CA 1.448 -0.552 0 CA-C-N 115.683 -0.69 . . . . 0.31 111.761 177.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -66.71 -42.18 86.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.345 0.593 . . . . 1.32 110.071 176.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.55 -29.88 68.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.548 -0.751 . . . . 0.42 110.687 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -76.19 -32.33 58.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.227 0.537 . . . . 0.55 109.785 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.6 -30.91 70.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.886 -0.597 . . . . 0.39 109.698 171.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.439 ' O ' ' HB3' ' A' ' 137' ' ' PRO . . . -75.7 0.69 60.59 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.759 -0.655 . . . . 0.27 112.724 178.223 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -99.07 -28.99 13.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.581 0.705 . . . . 2.43 109.584 175.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 50.4 mm-40 -97.95 -42.28 7.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.136 -0.938 . . . . 1.83 110.147 -176.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -135.22 70.59 68.65 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 116.162 -0.472 . . . . 0.69 110.11 176.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 133' ' ' GLY . 36.8 Cg_endo -65.88 -19.84 58.39 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.864 2.376 . . . . 0.63 112.632 -176.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.533 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 23.1 t80 -65.86 -37.82 87.19 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.378 -0.374 . . . . 2.31 110.564 -177.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.604 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 3.4 mm? -78.46 -44.71 23.92 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.905 -0.405 . . . . 1.02 109.905 178.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.15 -32.66 66.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.456 0.646 . . . . 0.35 109.961 178.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.5 tttt -54.5 -74.56 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.563 -1.199 . . . . 2.58 111.155 170.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.97 -28.21 43.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 112.944 0.72 . . . . 0.5 112.944 -173.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.604 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 19.7 m-30 -66.32 -55.28 16.73 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 120.517 -0.473 . . . . 0.62 110.139 -178.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -74.9 -27.89 60.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.325 -0.852 . . . . 2.58 111.383 -175.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 35.6 t -63.89 -26.95 68.83 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.531 -0.544 . . . . 1.32 109.531 174.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.421 ' O ' ' HG2' ' A' ' 150' ' ' LYS . . . 104.47 -5.02 44.02 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.818 -0.706 . . . . 1.09 112.557 177.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.42 ' HG2' HD11 ' A' ' 13' ' ' LEU . 51.7 tttp -62.74 -56.33 18.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.789 0.328 . . . . 1.98 111.084 -176.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.401 ' HA ' HD21 ' A' ' 13' ' ' LEU . . . -62.79 -36.49 83.3 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.32 -0.4 . . . . 0.34 110.632 178.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -57.0 -51.26 69.97 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.184 -0.462 . . . . 0.51 110.668 175.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 146' ' ' GLY . 73.0 mmtt -59.95 -42.71 94.67 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.369 -0.378 . . . . 2.82 111.007 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -59.95 -35.16 74.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.437 0.637 . . . . 0.49 110.043 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -77.34 -7.99 56.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.565 -0.743 . . . . 0.59 111.891 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 93.51 13.7 54.94 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.895 -0.669 . . . . 1.62 111.771 -176.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 70.28 111.6 0.05 Allowed 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 124.131 0.972 . . . . 4.12 111.4 -178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.248 -0.882 . . . . 4.01 110.557 178.558 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 88.3 mtp . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 109.892 -0.411 . . . . 23.59 109.892 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -141.62 -122.07 1.78 Allowed Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.824 -0.703 . . . . 22.47 111.857 -179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 23.1 t 72.63 -60.51 0.53 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.523 0.729 . . . . 21.51 110.748 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 23.3 t 55.73 57.64 5.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.435 0.636 . . . . 20.19 110.959 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -119.3 112.41 19.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.959 -0.564 . . . . 21.42 109.98 176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 36.5 m170 -80.82 140.67 35.31 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.144 -0.48 . . . . 18.2 110.484 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -116.75 57.62 0.78 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.927 -0.578 . . . . 16.06 109.926 178.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -72.94 103.74 3.84 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.788 -0.642 . . . . 13.27 109.71 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -169.28 127.86 0.99 Allowed 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 107.121 -1.437 . . . . 12.33 107.121 -172.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -73.89 49.91 0.34 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.011 0.745 . . . . 11.33 113.011 -168.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 34.2 m -156.82 33.19 0.3 Allowed 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.533 -1.284 . . . . 7.95 107.533 173.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 26' ' ' SER . 22.8 t -121.54 -42.76 2.42 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.464 0.913 . . . . 7.36 113.464 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . 0.795 ' N ' ' H ' ' A' ' 29' ' ' ASP . . . -158.38 -119.35 0.56 Allowed Glycine 0 CA--C 1.539 1.548 0 C-N-CA 120.252 -0.975 . . . . 4.57 115.299 -177.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . 0.616 ' HB2' ' HB2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -142.45 -161.76 1.3 Allowed 'General case' 0 C--N 1.324 -0.54 0 O-C-N 120.977 -1.307 . . . . 4.52 110.344 -174.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . 0.407 ' SD ' ' N ' ' A' ' 0' ' ' MET . 0.0 OUTLIER -78.37 -26.82 46.74 Favored 'General case' 0 N--CA 1.441 -0.92 0 N-CA-C 108.455 -0.943 . . . . 2.0 108.455 174.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.821 ' CE1' ' HD3' ' A' ' 30' ' ' LYS . 2.2 p90 -90.21 144.49 25.81 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.49 -0.777 . . . . 1.47 109.628 172.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.431 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 3.3 mmmp? -117.62 -173.43 2.42 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.934 -0.575 . . . . 3.15 109.818 -175.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.508 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 77.5 t80 -69.62 -38.95 77.42 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.584 -0.895 . . . . 2.35 108.584 173.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 1.7 mp0 -63.59 -26.21 68.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.487 -1.233 . . . . 4.16 111.628 179.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -78.43 -17.83 55.82 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 120.898 0.38 . . . . 2.57 110.969 -176.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.6 mt -80.78 126.12 78.65 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 108.412 -0.959 . . . . 0.69 108.412 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -42.12 114.05 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 123.328 2.685 . . . . 0.6 113.041 -176.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.43 -25.73 62.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.479 -0.782 . . . . 0.57 111.792 -176.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -62.27 -38.73 90.43 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 122.043 0.925 . . . . 1.37 109.677 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -80.94 -33.8 33.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.117 -1.401 . . . . 0.8 111.238 -178.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -66.48 -22.62 66.19 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.509 0.671 . . . . 1.73 109.235 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -72.85 -10.34 59.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.485 -1.234 . . . . 1.02 111.631 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.1 mt -100.64 -42.33 6.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.689 0.281 . . . . 0.93 111.55 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.466 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 25.9 ptt? -76.03 144.2 75.26 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-O 120.988 0.423 . . . . 1.15 110.962 -175.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -72.35 156.05 55.12 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.133 2.555 . . . . 0.9 113.623 -172.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -42.41 -47.57 7.28 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.735 2.957 . . . . 0.96 114.262 -175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.559 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.6 pm0 -56.56 -45.41 81.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.788 0.267 . . . . 1.83 111.687 -177.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.37 -16.04 62.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.191 0.52 . . . . 0.82 110.992 -178.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.466 ' HD2' ' O ' ' A' ' 14' ' ' MET . 32.0 mtp180 -90.98 -32.31 16.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.795 -0.639 . . . . 2.16 110.076 177.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 18.0 t70 -56.26 -49.32 74.54 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.67 -0.696 . . . . 1.06 111.86 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.575 ' O ' HD23 ' A' ' 25' ' ' LEU . 60.1 t80 -54.45 -57.54 10.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.43 -0.35 . . . . 0.65 111.349 178.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.612 HD21 ' OH ' ' A' ' 100' ' ' TYR . 88.6 mt -78.08 -6.69 55.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 119.06 0.846 . . . . 1.13 112.062 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 29.9 tt0 -68.66 -34.67 76.09 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.009 0.433 . . . . 2.06 110.077 163.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -77.93 -54.48 6.26 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.176 -0.466 . . . . 1.84 110.954 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.575 HD23 ' O ' ' A' ' 21' ' ' PHE . 3.3 mm? -55.27 132.02 46.87 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 1.05 110.488 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.585 ' H ' ' C ' ' A' ' -3' ' ' SER . 38.5 m -137.37 -88.0 0.28 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 120.507 -0.477 . . . . 1.78 112.206 -172.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.698 ' C ' ' H ' ' A' ' -2' ' ' GLY . 15.5 p-10 -132.58 119.41 20.45 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.898 0.38 . . . . 2.39 111.096 174.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.62 -46.94 1.07 Allowed Glycine 0 CA--C 1.542 1.765 0 N-CA-C 115.459 0.944 . . . . 0.93 115.459 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.795 ' H ' ' N ' ' A' ' -2' ' ' GLY . 0.3 OUTLIER -95.2 -6.84 40.72 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 115.206 1.558 . . . . 2.25 115.206 -170.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.821 ' HD3' ' CE1' ' A' ' 1' ' ' PHE . 90.7 mttt -80.59 -15.89 55.49 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.024 -1.102 . . . . 1.31 108.024 171.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 86.0 m -61.2 -31.59 71.36 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.567 -1.197 . . . . 0.8 110.235 175.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.571 HG12 ' O ' ' A' ' 29' ' ' ASP . 7.5 p -89.95 -23.98 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.98 0 CA-C-N 115.983 -0.553 . . . . 0.85 110.594 -178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.54 HD13 HD21 ' A' ' 52' ' ' LEU . 3.7 mm? -54.3 -52.41 61.57 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.194 0.198 . . . . 0.98 111.065 170.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -62.11 -29.59 70.44 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.681 0.277 . . . . 2.41 111.235 -178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.69 -41.89 99.35 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.04 -0.527 . . . . 1.96 110.348 175.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.622 HG12 ' OH ' ' A' ' 42' ' ' TYR . 63.7 t -68.42 -49.68 63.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.295 0.569 . . . . 0.98 110.147 177.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.67 ' CE1' ' HB1' ' A' ' 97' ' ' ALA . 28.0 m-85 -55.4 -49.32 72.66 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 114.138 1.162 . . . . 0.83 114.138 177.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -77.38 -5.46 49.77 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.937 -0.705 . . . . 2.18 111.262 -174.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -90.02 -76.38 0.43 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.942 -0.572 . . . . 1.56 109.559 169.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.63 -155.34 1.55 Allowed Glycine 0 CA--C 1.522 0.493 0 C-N-CA 121.299 -0.476 . . . . 1.54 112.881 -175.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -98.49 154.65 7.43 Favored 'Cis proline' 0 N--CA 1.454 -0.826 0 CA-C-N 118.472 1.136 . . . . 1.68 111.938 -7.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.622 ' OH ' HG12 ' A' ' 36' ' ' VAL . 1.0 OUTLIER -104.8 124.78 50.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.176 0.513 . . . . 1.28 110.71 -175.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -89.79 -13.62 36.28 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.684 -0.858 . . . . 3.51 108.684 171.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.606 ' OD1' ' HB3' ' A' ' 46' ' ' GLU . 6.1 p30 -148.69 149.87 32.2 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.831 -1.077 . . . . 1.52 108.51 -179.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 t -70.31 -16.28 62.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.004 0.431 . . . . 1.18 110.887 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.606 ' HB3' ' OD1' ' A' ' 44' ' ' ASN . 32.3 tt0 -60.13 -36.73 78.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.933 -0.576 . . . . 2.24 110.267 175.117 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -60.88 -38.85 87.08 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.212 -0.449 . . . . 2.26 111.051 177.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.5 t -64.97 -41.7 95.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.229 -0.442 . . . . 1.19 110.11 178.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.499 HD11 ' ND1' ' A' ' 67' ' ' HIS . 78.0 mt -66.28 -48.4 81.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.192 -0.458 . . . . 0.55 110.641 179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.93 -49.53 76.44 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.577 -0.738 . . . . 0.57 111.899 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.83 -38.64 82.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.171 0.51 . . . . 0.5 110.738 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.54 HD21 HD13 ' A' ' 33' ' ' LEU . 20.2 mt -72.6 -33.46 66.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.669 -0.696 . . . . 0.45 111.462 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -66.29 -26.38 67.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.031 0.443 . . . . 1.22 110.833 175.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -77.44 -50.21 13.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.759 -0.655 . . . . 3.05 110.532 176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.558 ' HB3' HG21 ' A' ' 32' ' ' VAL . 33.7 mmtt -65.38 -59.87 3.57 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.601 -0.727 . . . . 1.48 111.981 178.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.6 t -138.51 99.41 8.66 Favored Pre-proline 0 C--N 1.316 -0.869 0 C-N-CA 120.472 -0.491 . . . . 1.16 110.811 -173.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -40.3 -57.95 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.944 3.096 . . . . 0.58 113.176 -172.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -56.59 -35.61 68.42 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 114.49 -1.232 . . . . 2.45 111.933 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.419 HD11 ' HB3' ' A' ' 29' ' ' ASP . 53.9 mt -76.11 -41.32 50.61 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 119.575 -0.85 . . . . 1.42 109.23 -174.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.446 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -61.58 -35.14 90.68 Favored Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 114.42 -1.263 . . . . 0.37 111.801 177.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.15 -34.6 68.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.92 0.39 . . . . 0.48 110.425 174.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 66' ' ' LEU . 2.7 tppt? -67.22 -47.4 70.95 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.948 -0.569 . . . . 2.17 110.768 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.478 HG23 HH21 ' A' ' 93' ' ' ARG . 13.4 p -69.65 -26.7 31.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.182 0.515 . . . . 1.12 110.376 176.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 47.6 tt0 -64.56 -52.98 54.83 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.63 -0.714 . . . . 1.7 110.954 176.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 66' ' ' LEU . 45.3 pttt -65.7 -30.59 71.3 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.727 -0.842 . . . . 3.96 108.727 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.559 HD21 ' O ' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -72.95 -0.03 12.56 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 114.391 -1.277 . . . . 1.5 110.389 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.499 ' ND1' HD11 ' A' ' 49' ' ' ILE . 13.5 m80 -113.64 -48.25 2.94 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 115.843 -0.617 . . . . 2.34 110.201 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.45 -45.55 76.85 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.173 0.434 . . . . 0.4 112.173 -178.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 44.0 mtm -66.63 -47.7 71.76 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.239 0.542 . . . . 0.72 110.433 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.466 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 93.8 t -62.31 -41.85 93.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.424 -0.807 . . . . 0.79 110.161 179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.402 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 8.0 mmmm -63.26 -30.78 71.85 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 115.157 -0.929 . . . . 1.47 111.417 177.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 40.7 t -62.37 -43.31 99.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.289 0.566 . . . . 1.26 110.553 177.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -69.54 -39.02 77.7 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.343 -0.614 . . . . 1.54 109.343 177.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.536 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 75.1 mt -77.16 -14.37 14.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.652 0.739 . . . . 0.34 111.148 -179.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.74 -34.32 27.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.831 0.824 . . . . 0.35 109.325 176.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.65 -0.68 57.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.972 -1.467 . . . . 0.49 110.084 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.417 HD12 ' OD2' ' A' ' 131' ' ' ASP . 13.6 tp -91.4 138.39 31.62 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.462 -0.79 . . . . 0.71 109.827 -178.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.08 151.23 27.18 Favored Glycine 0 C--O 1.227 -0.3 0 CA-C-N 115.928 -0.578 . . . . 0.76 112.537 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -43.52 -42.72 11.05 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.921 3.081 . . . . 1.56 114.179 -176.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' CD ' ' H ' ' A' ' 80' ' ' GLU . 0.3 OUTLIER -81.02 -41.89 21.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.592 -0.276 . . . . 2.52 111.417 -177.085 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.22 82.3 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.568 0.699 . . . . 0.36 109.935 178.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.536 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 28.6 ttpp -53.54 -48.22 69.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.596 -1.184 . . . . 2.04 111.389 174.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.7 -39.69 91.6 Favored Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.798 -0.715 . . . . 0.41 112.191 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -67.34 -46.63 72.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.643 0.258 . . . . 1.65 110.869 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.01 90.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.088 0.471 . . . . 0.41 111.413 -177.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 41.2 mt-10 -65.71 -23.94 66.87 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.768 -0.651 . . . . 1.96 111.492 -176.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -93.98 -42.72 8.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 116.736 -0.211 . . . . 2.12 111.359 -179.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.3 p -60.38 -45.08 94.8 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.737 0.304 . . . . 0.57 111.037 -177.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.592 ' O ' ' HB2' ' A' ' 93' ' ' ARG . 1.7 mp -56.49 -40.13 66.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.959 -0.564 . . . . 1.09 110.481 176.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -74.74 -35.08 62.63 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.121 0.415 . . . . 2.82 112.121 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.537 HG22 ' OG ' ' A' ' 113' ' ' SER . 65.4 mt -63.84 -48.26 87.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-O 121.034 0.445 . . . . 0.51 109.834 176.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.7 -30.03 70.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.699 -0.682 . . . . 0.64 110.712 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.592 ' HB2' ' O ' ' A' ' 89' ' ' ILE . 11.5 ttt85 -70.49 -40.58 73.51 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.302 -0.863 . . . . 4.42 110.67 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.71 -32.29 83.67 Favored Glycine 0 C--N 1.332 0.325 0 C-N-CA 121.255 -0.498 . . . . 0.66 112.328 -178.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 27.7 mm -62.63 -44.53 99.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.275 0.559 . . . . 0.55 110.715 177.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.492 ' HA ' ' HB2' ' A' ' 99' ' ' TYR . 36.7 mtmm -91.74 8.85 35.07 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.903 -0.59 . . . . 2.7 110.275 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.67 ' HB1' ' CE1' ' A' ' 37' ' ' PHE . . . -97.02 -33.15 11.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.781 -0.645 . . . . 0.63 109.61 171.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.418 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 13.8 ptp180 -83.51 -3.34 57.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.161 -0.681 . . . . 3.1 109.161 172.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.492 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 0.6 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.112 -0.699 . . . . 0.97 109.112 164.345 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.612 ' OH ' HD21 ' A' ' 22' ' ' LEU . 26.9 m-85 -70.17 -48.53 56.87 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 116.033 -0.53 . . . . 1.48 110.97 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.418 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 23.5 p -62.15 -19.97 63.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.289 -0.869 . . . . 0.87 112.722 -173.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 105.39 1.72 40.91 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.695 -0.764 . . . . 1.16 112.208 -177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -101.41 60.32 0.9 Allowed 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.648 -0.501 . . . . 1.83 109.648 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.422 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 48.4 mt-10 -50.77 116.11 6.64 Favored Pre-proline 0 C--O 1.234 0.251 0 O-C-N 123.817 0.698 . . . . 1.75 111.691 -173.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 31.6 Cg_endo -64.57 157.16 56.81 Favored 'Trans proline' 0 C--O 1.236 0.396 0 C-N-CA 123.49 2.793 . . . . 0.53 113.324 -174.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.416 ' O ' HD13 ' A' ' 110' ' ' LEU . 75.3 p -87.86 178.0 6.83 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.524 -0.307 . . . . 1.48 110.31 174.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.64 -25.49 65.76 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.126 0.489 . . . . 2.88 109.972 175.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.469 ' HA ' ' HG2' ' A' ' 111' ' ' LYS . 23.3 m-20 -71.11 -30.84 67.03 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 115.917 -0.583 . . . . 2.24 110.541 178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.15 -46.48 80.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.19 0.519 . . . . 1.73 109.802 173.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' THR . 10.2 mp -64.91 -47.89 76.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.601 -0.727 . . . . 0.82 111.691 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 108' ' ' ASP . 16.0 ptpt -60.89 -38.5 85.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.912 0.387 . . . . 1.74 110.283 -177.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.21 75.27 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.926 -0.579 . . . . 0.47 111.229 178.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.537 ' OG ' HG22 ' A' ' 91' ' ' ILE . 24.7 t -55.33 -48.01 74.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.986 -0.552 . . . . 1.34 110.925 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.619 ' O ' HG22 ' A' ' 117' ' ' VAL . 3.6 m -77.29 -28.04 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.547 0.689 . . . . 0.65 109.534 -176.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 22.2 ttmm -59.11 -44.82 92.01 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.208 -0.905 . . . . 1.72 111.675 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.485 ' O ' HD13 ' A' ' 120' ' ' LEU . 20.3 mt-10 -71.14 -34.32 70.9 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.026 -0.67 . . . . 2.27 111.253 -176.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.1 m -68.89 -22.41 26.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 C-N-CA 120.365 -0.534 . . . . 0.81 109.728 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 149' ' ' ALA . 22.0 mt -83.44 -36.82 23.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.483 -0.326 . . . . 1.21 110.485 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -58.62 -39.53 80.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 121.615 0.722 . . . . 0.95 109.293 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.8 mp -73.11 -48.74 33.08 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 114.896 -1.047 . . . . 1.06 112.165 174.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.626 ' CE2' ' HB3' ' A' ' 143' ' ' PHE . 0.0 OUTLIER -70.59 -35.52 73.07 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 119.011 -1.075 . . . . 1.54 111.234 -168.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -61.72 -33.12 73.46 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.006 0.431 . . . . 1.98 110.59 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -90.09 -1.7 57.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.7 112.464 -176.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.577 ' O ' ' HE3' ' A' ' 129' ' ' LYS . 50.8 mtm -74.82 157.81 34.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.333 -0.547 . . . . 0.5 111.076 178.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.5 m -63.21 149.08 46.32 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.148 -0.478 . . . . 1.18 110.368 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -59.34 -43.28 92.78 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.543 0.211 . . . . 2.21 111.534 -174.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.41 -25.96 68.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.836 0.35 . . . . 0.42 111.046 178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.76 -36.79 31.85 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.801 -0.714 . . . . 0.31 111.608 177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.577 ' HE3' ' O ' ' A' ' 124' ' ' MET . 97.5 mttt -65.46 -45.57 83.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.449 0.643 . . . . 1.32 110.014 179.458 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.31 -41.27 94.21 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.091 -0.958 . . . . 0.42 111.652 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.417 ' OD2' HD12 ' A' ' 77' ' ' LEU . 38.7 t70 -71.55 -31.47 67.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.059 0.457 . . . . 0.55 109.853 -175.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -61.86 -29.09 69.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.865 -0.607 . . . . 0.39 110.148 173.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . 0.411 ' HA2' ' CB ' ' A' ' 140' ' ' ALA . . . -72.73 -22.15 79.22 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.98 -0.629 . . . . 0.27 112.737 -179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -81.87 -35.39 29.35 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.716 0.769 . . . . 2.43 109.867 -179.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 131' ' ' ASP . 6.5 mm100 -89.86 -36.88 14.82 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.521 -1.218 . . . . 1.83 110.794 -176.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.466 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 48.7 m-85 -130.21 79.27 73.04 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-O 121.022 0.439 . . . . 0.69 110.408 175.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -64.98 -37.75 32.05 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 123.146 2.564 . . . . 0.63 113.141 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.518 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 41.6 t80 -69.3 -38.05 78.11 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.814 0.34 . . . . 2.31 110.592 -175.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 48.3 mt -75.58 -44.02 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.441 -0.345 . . . . 1.02 110.956 178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.411 ' CB ' ' HA2' ' A' ' 133' ' ' GLY . . . -58.76 -37.51 76.41 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.988 0.423 . . . . 0.35 109.961 177.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 16.9 tppt? -48.1 -69.51 0.12 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.212 -0.903 . . . . 2.58 111.532 171.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 138' ' ' PHE . 2.8 m -63.57 -27.45 42.98 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 115.372 -0.831 . . . . 0.5 112.569 -174.031 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.626 ' HB3' ' CE2' ' A' ' 121' ' ' TYR . 22.7 m-30 -74.79 -54.12 7.9 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.065 -0.654 . . . . 0.62 110.263 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.79 -32.45 73.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.068 -0.515 . . . . 2.58 111.941 -176.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.2 t -75.24 -7.9 55.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.511 -0.313 . . . . 1.32 110.859 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 76.7 13.17 83.81 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.867 -0.683 . . . . 1.09 111.774 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.37 -56.09 9.73 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.972 0.415 . . . . 1.98 110.525 -177.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -66.15 -29.82 70.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.952 -0.567 . . . . 0.34 110.073 178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 118' ' ' LEU . . . -61.25 -36.82 81.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.46 -0.791 . . . . 0.51 111.137 179.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.06 -32.76 61.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.122 -0.49 . . . . 2.82 110.169 -179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 58.7 t80 -68.51 -31.33 70.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.92 -0.582 . . . . 0.49 109.901 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.496 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.6 -15.85 62.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.961 -0.563 . . . . 0.59 110.851 175.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 89.65 31.77 10.98 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.839 -0.619 . . . . 1.62 113.101 176.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.482 ' HG3' HD22 ' A' ' 155' ' ' ASN . 11.3 pt-20 -160.36 -168.2 2.1 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 117.256 0.528 . . . . 4.12 111.425 176.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.482 HD22 ' HG3' ' A' ' 154' ' ' GLU . 50.0 m-80 . . . . . 0 C--O 1.248 1.007 0 C-N-CA 123.568 0.747 . . . . 4.01 110.706 -178.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 14.0 tmm? . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 109.456 -0.572 . . . . 23.59 109.456 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 105.21 104.92 2.98 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.72 -0.753 . . . . 22.47 111.839 -178.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 5.3 p -77.61 -18.5 56.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.088 0.47 . . . . 21.51 110.442 178.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 14.5 m 58.25 30.95 20.22 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.09 -0.959 . . . . 20.19 112.536 170.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 40.7 m170 -93.31 -20.27 20.55 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 121.054 -0.259 . . . . 21.42 111.049 -178.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -80.62 81.89 6.77 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.888 -0.412 . . . . 18.2 109.888 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.83 -21.59 60.94 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.019 -0.734 . . . . 16.06 109.019 177.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 22.8 p80 -136.78 141.54 42.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.027 -0.988 . . . . 13.27 108.631 172.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 64.31 90.2 0.09 Allowed 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.682 0.614 . . . . 12.33 110.692 -177.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -85.98 -161.39 0.62 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.987 -0.551 . . . . 11.33 110.209 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 14.8 m -60.32 122.67 15.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.763 0.316 . . . . 7.95 111.039 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.8 m -79.64 66.72 5.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.196 0.522 . . . . 7.36 110.303 177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 122.39 -147.67 16.97 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-N 115.714 -0.675 . . . . 4.57 111.534 -177.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 62.0 m80 -97.92 115.55 28.36 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 110.168 -0.308 . . . . 4.52 110.168 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 2.4 mmt -96.57 111.35 23.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.547 0.689 . . . . 2.0 112.08 -178.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.524 ' CE1' ' HA ' ' A' ' 100' ' ' TYR . 13.6 p90 -95.55 154.27 17.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.309 -0.859 . . . . 1.47 109.029 173.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.488 ' HB3' ' OE1' ' A' ' 4' ' ' GLU . 4.2 mmmp? -129.32 171.72 12.21 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.667 0.27 . . . . 3.15 110.906 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.615 ' OH ' ' HD2' ' A' ' 19' ' ' ARG . 87.1 t80 -56.97 -41.32 78.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.508 0.67 . . . . 2.35 109.89 175.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.488 ' OE1' ' HB3' ' A' ' 2' ' ' LYS . 2.1 mp0 -64.35 -24.5 67.67 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.809 -1.087 . . . . 4.16 111.999 -178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -82.91 -14.67 53.75 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.561 -0.456 . . . . 2.57 110.649 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.6 mt -82.18 128.9 66.03 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.222 -0.658 . . . . 0.69 109.222 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -42.49 115.18 0.47 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 123.573 2.849 . . . . 0.6 112.763 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -21.67 66.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.534 -0.757 . . . . 0.57 112.112 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -67.35 -37.07 82.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.792 0.806 . . . . 1.37 109.685 178.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -80.91 -28.76 35.75 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.396 -1.274 . . . . 0.8 111.127 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 14.8 mtm180 -69.46 -21.28 63.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.723 -0.473 . . . . 1.73 109.723 -178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.467 ' OD2' ' HE2' ' A' ' 147' ' ' LYS . 13.3 t70 -65.68 -21.14 66.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.313 -0.858 . . . . 1.02 110.52 176.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 66.2 mt -89.41 -12.43 40.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.947 -0.57 . . . . 0.93 110.937 -179.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 68.1 mtm -95.35 129.2 35.76 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-O 121.029 0.442 . . . . 1.15 110.531 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.474 ' HB2' ' OE1' ' A' ' 17' ' ' GLU . 38.3 Cg_endo -66.67 153.02 79.46 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.858 2.372 . . . . 0.9 112.53 -176.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -42.97 -47.14 8.51 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 123.384 2.723 . . . . 0.96 113.882 -175.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 15' ' ' PRO . 1.6 pm0 -60.81 -45.3 94.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.661 0.267 . . . . 1.83 111.609 -178.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -28.46 69.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.82 110.856 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.615 ' HD2' ' OH ' ' A' ' 3' ' ' TYR . 45.3 mtm105 -89.11 -29.03 19.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.924 -0.58 . . . . 2.16 111.132 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 28.4 t70 -56.02 -38.84 71.07 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.419 0.628 . . . . 1.06 111.134 179.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.606 ' O ' HD23 ' A' ' 25' ' ' LEU . 66.2 t80 -57.71 -58.78 6.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.55 -0.75 . . . . 0.65 110.985 174.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.468 HD21 ' CE1' ' A' ' 100' ' ' TYR . 71.0 mt -75.04 -7.82 54.78 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 119.456 1.026 . . . . 1.13 111.941 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.462 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 6.3 tp60 -67.57 -41.63 83.87 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.247 0.546 . . . . 2.06 110.187 162.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -73.8 -52.46 13.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.585 -0.734 . . . . 1.84 110.838 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 21' ' ' PHE . 4.4 mm? -50.61 121.36 5.69 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.632 1.206 . . . . 1.05 112.737 -177.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.711 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 15.6 m -141.17 -169.43 2.84 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 112.547 -2.115 . . . . 1.78 107.938 178.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -57.13 144.05 36.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 118.28 0.491 . . . . 2.39 111.026 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.9 -58.18 0.63 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.799 -0.715 . . . . 0.93 112.248 -178.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.653 ' O ' HG12 ' A' ' 32' ' ' VAL . 40.9 m-20 -87.12 -30.95 20.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.571 0.224 . . . . 2.25 111.29 -177.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.711 ' HG3' ' O ' ' A' ' 26' ' ' SER . 3.0 mtpm? -69.75 -17.97 63.48 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.659 -0.651 . . . . 1.31 110.072 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.434 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 9.9 m -64.75 -36.24 83.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.894 -1.048 . . . . 0.8 110.823 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.661 ' CG2' ' HG2' ' A' ' 55' ' ' LYS . 12.2 p -81.99 -32.02 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 116.183 -0.462 . . . . 0.85 112.147 -174.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.587 HD13 HD21 ' A' ' 52' ' ' LEU . 4.4 mm? -55.08 -42.74 73.22 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.348 . . . . 0.98 110.062 175.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 34' ' ' LYS . 3.7 ttpm? -63.29 -29.01 70.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.427 0.632 . . . . 2.41 110.341 -178.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 31' ' ' THR . 9.8 mm-40 -79.26 -45.33 19.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.232 -0.895 . . . . 1.96 110.769 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.543 HG22 ' O ' ' A' ' 32' ' ' VAL . 12.0 m -75.79 -37.0 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 N-CA-C 112.276 0.473 . . . . 0.98 112.276 -175.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -62.12 -43.97 97.66 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.812 1.042 . . . . 0.83 113.812 171.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -80.51 -17.48 51.43 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.694 -0.803 . . . . 2.18 110.57 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.58 -77.51 0.09 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.197 -0.456 . . . . 1.56 109.904 168.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 45.78 -147.16 2.37 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 121.058 -0.591 . . . . 1.54 112.558 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -91.22 123.14 4.82 Favored 'Cis proline' 0 N--CA 1.457 -0.654 0 CA-C-N 118.747 1.274 . . . . 1.68 110.541 -12.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.559 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 21.4 m-85 -99.04 116.95 32.44 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.55 0.69 . . . . 1.28 111.873 -169.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -71.02 -15.88 62.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.708 -1.133 . . . . 3.51 111.422 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 46' ' ' GLU . 9.1 p30 -147.2 164.45 33.12 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.156 -0.313 . . . . 1.52 110.156 -174.106 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.458 HG21 ' CD2' ' A' ' 67' ' ' HIS . 9.2 m -73.18 -32.22 64.69 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.188 -0.46 . . . . 1.18 111.918 -176.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.435 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 50.1 mt-10 -58.36 -41.81 85.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.565 0.222 . . . . 2.24 111.051 -178.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.559 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.3 OUTLIER -61.98 -33.51 74.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.588 -0.278 . . . . 2.26 111.529 176.629 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.4 m -71.69 -40.29 69.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.27 0.557 . . . . 1.19 109.821 177.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.84 -44.86 98.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.34 -0.845 . . . . 0.55 110.266 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.578 ' O ' ' HG2' ' A' ' 54' ' ' LYS . . . -55.9 -49.24 73.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.368 -0.833 . . . . 0.57 111.255 175.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB1' ' CG1' ' A' ' 36' ' ' VAL . . . -53.33 -41.6 65.89 Favored 'General case' 0 CA--C 1.52 -0.212 0 CA-C-N 115.987 -0.551 . . . . 0.5 111.017 178.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 33' ' ' LEU . 63.3 mt -70.54 -40.82 73.19 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.801 -0.636 . . . . 0.45 111.199 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 91.3 mttt -62.89 -33.64 75.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.08 0.4 . . . . 1.22 112.08 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 50' ' ' ALA . 33.4 mmtp -71.91 -28.44 63.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.393 -0.367 . . . . 3.05 111.463 -177.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.661 ' HG2' ' CG2' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -99.02 -50.53 4.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.08 0.466 . . . . 1.48 110.818 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 t -127.42 93.67 40.2 Favored Pre-proline 0 C--N 1.319 -0.726 0 N-CA-C 108.697 -0.853 . . . . 1.16 108.697 -179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -49.93 -53.31 7.28 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 123.798 2.998 . . . . 0.58 112.63 -175.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 17.1 tp10 -57.34 -37.68 72.94 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 114.481 -1.236 . . . . 2.45 111.655 177.095 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 29' ' ' ASP . 1.6 tt -70.04 -45.78 66.42 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.246 -1.02 . . . . 1.42 108.246 -174.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.417 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.88 -32.43 84.14 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 114.235 -1.348 . . . . 0.37 111.865 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.47 -36.78 81.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.809 0.338 . . . . 0.48 110.528 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 96.2 mttt -62.72 -53.02 60.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.087 -0.506 . . . . 2.17 110.836 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.417 HG12 ' HA2' ' A' ' 60' ' ' GLY . 14.7 p -67.61 -28.71 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 116.489 -0.323 . . . . 1.12 111.203 -179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.6 OUTLIER -62.04 -60.02 4.22 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 110.096 -0.335 . . . . 1.7 110.096 179.103 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.647 ' O ' ' HG3' ' A' ' 69' ' ' MET . 70.8 mmtt -64.14 -36.64 84.69 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.298 0.57 . . . . 3.96 109.827 -176.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 21' ' ' PHE . 15.1 tp -63.24 -38.79 92.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.94 -1.027 . . . . 1.5 110.648 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.458 ' CD2' HG21 ' A' ' 45' ' ' THR . 48.6 t-80 -81.62 -33.34 31.53 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.746 -0.661 . . . . 2.34 109.62 -175.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.69 -36.56 83.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.222 -0.899 . . . . 0.4 111.185 177.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.647 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 26.6 mtm -63.38 -54.15 41.31 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.203 0.525 . . . . 0.72 109.918 176.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 97.2 t -54.74 -40.77 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 CA-C-N 115.296 -0.866 . . . . 0.79 110.108 175.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -65.66 -40.73 92.76 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.77 -1.105 . . . . 1.47 111.207 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 48.3 m -57.57 -37.69 73.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.827 0.346 . . . . 1.26 110.721 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HD3' ' O ' ' A' ' 135' ' ' GLN . 53.8 mttm -67.45 -46.69 72.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 1.54 110.31 176.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 73.8 mt -68.88 -29.29 42.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.005 0.431 . . . . 0.34 111.698 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.33 -37.47 85.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.487 0.66 . . . . 0.35 109.956 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -84.61 -1.47 56.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.789 -1.096 . . . . 0.49 111.152 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.42 HD11 ' HA ' ' A' ' 132' ' ' PHE . 8.9 tp -92.85 134.99 34.54 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.169 -0.469 . . . . 0.71 109.857 -176.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.63 149.83 51.58 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.599 -0.81 . . . . 0.76 111.846 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -39.05 -36.33 0.7 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 124.381 3.387 . . . . 1.56 114.452 -179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.88 -56.03 18.31 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.335 0.588 . . . . 2.52 109.68 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.94 -29.99 35.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.664 -0.698 . . . . 0.36 110.807 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 56.2 tttp -61.74 -38.85 89.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.578 -0.737 . . . . 2.04 110.86 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.57 -40.24 95.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.584 -0.817 . . . . 0.41 111.443 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 32.7 t80 -67.79 -49.88 59.96 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.837 -0.181 . . . . 1.65 111.223 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.97 -51.89 59.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.945 0.403 . . . . 0.41 112.004 -176.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -71.06 -27.7 63.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.335 -0.393 . . . . 1.96 111.359 -175.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.495 ' O ' ' HB3' ' A' ' 90' ' ' GLU . 58.7 tttp -84.08 -39.48 19.49 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 120.552 0.215 . . . . 2.12 111.049 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.6 p -65.24 -46.09 82.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.795 0.331 . . . . 0.57 110.228 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.84 -31.59 52.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 116.017 -0.538 . . . . 1.09 110.339 175.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.495 ' HB3' ' O ' ' A' ' 87' ' ' LYS . 9.3 tp10 -61.91 -47.56 84.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.884 0.374 . . . . 2.82 110.269 174.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.465 HG22 ' OG ' ' A' ' 113' ' ' SER . 71.9 mt -63.09 -46.86 95.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.215 -0.448 . . . . 0.51 110.398 178.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.413 ' O ' ' HD2' ' A' ' 96' ' ' LYS . . . -64.33 -35.97 82.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.827 -0.624 . . . . 0.64 110.829 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.451 ' HA ' ' HD3' ' A' ' 96' ' ' LYS . 46.1 mtm180 -62.18 -41.46 98.35 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.795 -0.639 . . . . 4.42 110.813 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.525 ' O ' ' HG2' ' A' ' 98' ' ' ARG . . . -60.82 -33.94 85.08 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.768 -0.729 . . . . 0.66 112.013 -178.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 29.5 mm -64.0 -43.42 97.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.598 0.237 . . . . 0.55 111.508 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.506 ' HZ2' ' HB3' ' A' ' 96' ' ' LYS . 0.0 OUTLIER -93.48 -9.47 38.31 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 119.916 -0.714 . . . . 2.7 110.753 -179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.21 78.02 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.056 0.455 . . . . 0.63 109.891 170.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.525 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 12.1 ptm180 -85.23 3.43 39.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.898 -0.592 . . . . 3.1 110.043 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.443 ' HB2' ' HA ' ' A' ' 96' ' ' LYS . 3.2 m-85 -90.42 -45.51 8.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.037 -0.727 . . . . 0.97 109.037 162.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.524 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 35.2 m-85 -59.63 -34.25 72.55 Favored 'General case' 0 CA--C 1.521 -0.151 0 CA-C-N 115.941 -0.572 . . . . 1.48 111.785 -177.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.5 p -71.73 -2.66 18.26 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.404 0.52 . . . . 0.87 112.404 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 92.58 31.64 8.68 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.807 -0.711 . . . . 1.16 112.304 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.479 ' HB2' ' O ' ' A' ' 98' ' ' ARG . 44.7 m-80 -130.8 176.23 8.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.53 -0.545 . . . . 1.83 109.53 -178.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HA ' ' HD2' ' A' ' 105' ' ' PRO . 49.8 mt-10 -142.73 106.87 5.43 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 111.654 0.242 . . . . 1.75 111.654 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 104' ' ' GLU . 13.4 Cg_endo -59.17 160.29 19.58 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.834 2.356 . . . . 0.53 111.886 173.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 72.2 p -86.1 165.15 16.83 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.127 -0.694 . . . . 1.48 109.127 176.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 8.7 ptpp? -61.97 -23.72 66.56 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.334 -0.546 . . . . 2.88 109.88 177.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.412 ' HA ' ' HD2' ' A' ' 111' ' ' LYS . 16.4 m-20 -72.27 -32.43 66.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.693 -0.685 . . . . 2.24 110.937 178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -62.98 -41.29 99.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.421 0.629 . . . . 1.73 109.694 173.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.425 ' O ' HG13 ' A' ' 114' ' ' VAL . 7.5 mp -66.19 -41.07 90.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.229 -0.896 . . . . 0.82 110.413 177.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 93.5 mttt -54.49 -52.72 61.04 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 120.959 0.409 . . . . 1.74 109.939 174.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' A' ' 116' ' ' GLU . . . -59.84 -43.34 94.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.611 -0.722 . . . . 0.47 111.143 -179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.506 ' O ' HG13 ' A' ' 117' ' ' VAL . 44.2 t -55.93 -48.84 74.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.114 -0.494 . . . . 1.34 111.667 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.774 HG23 ' HB2' ' A' ' 152' ' ' ALA . 5.0 m -80.95 -24.85 10.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.616 0.722 . . . . 0.65 110.056 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 37.7 ttmt -66.63 -41.5 88.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.267 -0.879 . . . . 1.72 111.333 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.458 ' O ' HD13 ' A' ' 120' ' ' LEU . 12.7 mm-40 -71.87 -35.46 69.81 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.57 -0.452 . . . . 2.27 110.706 -178.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.634 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -65.37 -33.16 61.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.678 -0.409 . . . . 0.81 110.251 176.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.559 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 85.1 mt -72.78 -34.85 67.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.038 -0.356 . . . . 1.21 110.038 176.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -60.01 -43.8 95.0 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.148 -0.686 . . . . 0.95 109.148 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.0 mp -69.83 -48.07 60.36 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.123 -0.944 . . . . 1.06 111.498 174.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.623 ' O ' ' HE2' ' A' ' 129' ' ' LYS . 37.9 t80 -69.61 -37.92 77.07 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.878 -0.729 . . . . 1.54 111.702 -168.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -61.07 -33.02 72.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.828 0.347 . . . . 1.98 111.097 178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -87.36 -8.03 57.09 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.746 0.647 . . . . 0.7 112.746 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -74.3 159.71 32.06 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.275 -0.57 . . . . 0.5 111.558 -176.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -59.26 145.06 44.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.067 -0.515 . . . . 1.18 110.494 173.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.91 -43.39 98.92 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.275 -0.42 . . . . 2.21 111.999 -174.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.4 -29.74 70.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.987 0.422 . . . . 0.42 110.656 177.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -72.99 -36.27 57.29 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.563 -0.744 . . . . 0.31 111.602 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.623 ' HE2' ' O ' ' A' ' 121' ' ' TYR . 98.9 mttt -63.6 -45.98 87.88 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.336 0.588 . . . . 1.32 110.061 177.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.83 -33.32 74.56 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.443 -0.799 . . . . 0.42 111.431 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -74.21 -31.95 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.601 -0.518 . . . . 0.55 109.601 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.42 ' HA ' HD11 ' A' ' 77' ' ' LEU . 90.9 t80 -60.11 -34.22 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.699 -0.682 . . . . 0.39 109.811 172.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -73.15 -10.42 78.2 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.792 -0.64 . . . . 0.27 113.202 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -87.72 -29.34 21.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.351 0.596 . . . . 2.43 110.268 177.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.5 ' O ' ' HD3' ' A' ' 73' ' ' LYS . 69.5 mm-40 -100.98 -37.81 8.47 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.192 -0.913 . . . . 1.83 111.046 -176.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -128.05 71.47 78.94 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.907 0.384 . . . . 0.69 110.073 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -62.44 -36.66 64.92 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 123.045 2.496 . . . . 0.63 112.427 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.528 ' O ' HG13 ' A' ' 142' ' ' VAL . 61.7 t80 -64.31 -41.62 96.75 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.46 -0.336 . . . . 2.31 110.344 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.445 HD21 ' HD3' ' A' ' 15' ' ' PRO . 94.9 mt -72.02 -44.68 63.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.486 -0.325 . . . . 1.02 110.333 178.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 144' ' ' GLU . . . -57.19 -40.71 77.92 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.95 -0.389 . . . . 0.35 109.95 177.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 22.6 ttpp -46.25 -71.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.323 -0.853 . . . . 2.58 111.193 172.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 138' ' ' PHE . 1.1 m -62.83 -26.51 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.658 -0.701 . . . . 0.5 112.259 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -74.51 -41.64 60.3 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.848 -0.741 . . . . 0.62 110.488 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 140' ' ' ALA . 37.3 mt-10 -79.68 -31.71 41.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.747 0.308 . . . . 2.58 111.073 -178.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 57.3 m -70.18 -10.76 59.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.183 -0.462 . . . . 1.32 111.224 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 79.41 14.99 80.78 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.853 -0.689 . . . . 1.09 111.547 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.467 ' HE2' ' OD2' ' A' ' 12' ' ' ASP . 54.8 tptt -69.49 -59.9 2.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.805 0.336 . . . . 1.98 110.585 -177.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.3 -33.28 75.46 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.132 0.491 . . . . 0.34 109.781 177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.559 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -59.32 -45.61 90.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.342 -0.845 . . . . 0.51 111.136 178.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -67.47 -39.81 85.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.317 -0.401 . . . . 2.82 110.405 -178.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -59.81 -39.53 85.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.917 -0.583 . . . . 0.49 110.537 176.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.774 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -73.2 -21.13 60.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.49 . . . . 0.59 111.515 179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 84.41 9.67 81.3 Favored Glycine 0 N--CA 1.444 -0.784 0 N-CA-C 110.447 -1.061 . . . . 1.62 110.447 -171.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 65.2 168.08 0.19 Allowed 'General case' 0 C--O 1.233 0.188 0 CA-C-O 122.069 0.938 . . . . 4.12 112.527 -175.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 . . . . . 0 C--O 1.248 1.015 0 CA-C-N 114.543 -1.208 . . . . 4.01 110.098 -176.408 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 88.5 mtp . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.699 0.285 . . . . 23.59 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 70.63 -166.3 51.57 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.929 -0.653 . . . . 22.47 112.155 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 5.9 p -149.0 -78.93 0.14 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.62 0.248 . . . . 21.51 111.139 179.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 32.4 t -122.58 -43.05 2.29 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.083 -0.247 . . . . 20.19 111.166 -179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -68.66 -66.84 0.52 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.765 0.317 . . . . 21.42 111.16 -176.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -127.41 115.81 19.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.781 0.324 . . . . 18.2 110.746 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -148.34 35.99 0.81 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.171 0.51 . . . . 16.06 110.49 176.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -82.58 176.44 9.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.127 -0.488 . . . . 13.27 109.885 175.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 59.4 m80 58.15 48.81 12.3 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.913 -0.403 . . . . 12.33 109.913 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -77.09 60.23 1.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.619 0.723 . . . . 11.33 111.298 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 9.0 p -155.18 136.43 13.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.8 -1.091 . . . . 7.95 109.066 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 19.6 p -49.13 -58.11 5.53 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 123.548 0.53 . . . . 7.36 112.047 -172.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 153.41 -49.81 0.51 Allowed Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 111.524 -0.63 . . . . 4.57 111.524 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -81.05 69.69 7.71 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.275 -0.639 . . . . 4.52 109.275 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 84.1 mmm -87.88 134.35 33.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.557 -0.747 . . . . 2.0 109.751 -179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -77.67 146.21 36.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.103 0.478 . . . . 1.47 110.116 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 5' ' ' ASP . 10.5 mtmp? -121.62 155.65 34.64 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.964 -0.562 . . . . 3.15 109.676 177.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.733 ' CE1' ' HB3' ' A' ' 22' ' ' LEU . 47.6 m-85 -83.79 -0.16 49.87 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.07 0.938 . . . . 2.35 109.592 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -84.16 -19.79 33.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.94 -1.482 . . . . 4.16 108.881 170.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 2' ' ' LYS . 9.8 m-20 -96.76 -14.58 21.87 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.88 -0.6 . . . . 2.57 110.344 -174.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.08 130.69 71.74 Favored Pre-proline 0 N--CA 1.449 -0.491 0 N-CA-C 108.601 -0.889 . . . . 0.69 108.601 176.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_exo -40.5 106.82 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.342 2.694 . . . . 0.6 112.533 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.79 -22.3 66.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.574 -0.739 . . . . 0.57 111.474 -174.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -63.91 -29.26 70.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.918 0.866 . . . . 1.37 109.559 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 40.4 t80 -91.8 -27.92 17.69 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 114.178 -1.374 . . . . 0.8 110.723 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' HD2' ' SD ' ' A' ' 14' ' ' MET . 7.3 mmm180 -68.13 -23.8 64.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.336 0.589 . . . . 1.73 109.544 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -63.6 -30.12 71.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.989 -1.005 . . . . 1.02 110.587 173.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.581 HD22 HG21 ' A' ' 142' ' ' VAL . 13.6 mt -82.34 -14.94 54.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.961 -0.563 . . . . 0.93 110.246 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.411 ' SD ' ' HD2' ' A' ' 11' ' ' ARG . 66.9 mtt -71.16 130.19 88.3 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 1.15 110.616 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 14' ' ' MET . 23.7 Cg_exo -63.48 126.62 18.02 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.267 1.978 . . . . 0.9 111.683 176.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -40.33 -48.78 4.06 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.963 3.109 . . . . 0.96 114.571 -173.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -75.99 -24.17 55.32 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.814 0.301 . . . . 1.83 111.814 -175.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.34 54.97 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.265 -0.643 . . . . 0.82 109.265 174.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 mtp180 -71.61 -29.71 64.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.221 -0.899 . . . . 2.16 110.242 173.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -49.49 -53.72 21.67 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.849 0.718 . . . . 1.06 110.798 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.542 ' O ' ' HB2' ' A' ' 24' ' ' ASN . 87.6 t80 -52.88 -62.11 1.86 Allowed 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.054 -0.521 . . . . 0.65 111.723 178.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.733 ' HB3' ' CE1' ' A' ' 3' ' ' TYR . 36.5 mt -69.25 -20.14 63.94 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 118.856 0.753 . . . . 1.13 111.821 -177.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -64.7 -31.81 73.19 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 119.187 0.903 . . . . 2.06 110.91 166.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 21' ' ' PHE . 0.9 OUTLIER -68.11 -47.65 67.58 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 116.073 -0.512 . . . . 1.84 112.178 179.505 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.495 ' HG ' ' OH ' ' A' ' 100' ' ' TYR . 3.2 mm? -59.53 140.54 56.19 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.32 0.581 . . . . 1.05 111.177 -178.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.3 t -122.53 -68.56 0.88 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.221 -0.9 . . . . 1.78 111.463 -174.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -151.13 -70.51 0.17 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.016 0.376 . . . . 2.39 112.016 -174.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -66.36 -27.3 72.96 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 121.105 -0.569 . . . . 0.93 112.687 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.587 ' O ' HG12 ' A' ' 32' ' ' VAL . 1.1 p30 -73.84 -35.66 64.82 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.892 0.377 . . . . 2.25 110.843 178.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -63.95 -30.06 71.17 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.006 0.432 . . . . 1.31 110.929 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 44.3 m -56.28 -43.86 79.22 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.656 -0.702 . . . . 0.8 111.223 177.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.12 -28.55 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-N 115.957 -0.565 . . . . 0.85 110.39 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 52' ' ' LEU . 4.0 mm? -55.79 -46.72 77.9 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 121.119 0.485 . . . . 0.98 109.799 168.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.486 ' HG2' ' HE3' ' A' ' 38' ' ' LYS . 37.2 ttmt -57.06 -29.92 63.83 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.326 -0.852 . . . . 2.41 110.665 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -78.92 -34.18 44.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.577 -0.738 . . . . 1.96 111.232 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 78.4 t -71.29 -49.51 47.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.246 0.546 . . . . 0.98 110.478 178.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.542 ' HE2' ' CD2' ' A' ' 100' ' ' TYR . 35.4 m-85 -57.43 -24.63 56.73 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.174 0.805 . . . . 0.83 113.174 176.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE3' ' HG2' ' A' ' 34' ' ' LYS . 9.7 mtmp? -101.42 14.68 31.22 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 119.966 -0.694 . . . . 2.18 110.911 176.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.86 23.33 10.75 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.086 -0.506 . . . . 1.56 110.747 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -83.64 -149.86 9.73 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.88 -0.676 . . . . 1.54 111.852 174.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.0 162.94 86.45 Favored 'Cis proline' 0 N--CA 1.462 -0.346 0 CA-C-N 118.827 1.313 . . . . 1.68 112.064 -2.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -119.01 134.06 55.43 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.955 -0.566 . . . . 1.28 110.217 -178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -91.39 -6.29 53.13 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.099 -0.955 . . . . 3.51 109.981 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.406 HD21 ' HG3' ' A' ' 47' ' ' GLU . 5.7 p30 -156.15 149.99 25.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.619 -0.719 . . . . 1.52 109.607 -178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.2 m -61.6 -26.59 68.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.518 -0.765 . . . . 1.18 111.45 -177.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.99 -33.2 75.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.981 -0.554 . . . . 2.24 111.833 -177.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' HG3' HD21 ' A' ' 44' ' ' ASN . 44.5 mt-10 -63.11 -35.33 79.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.864 0.364 . . . . 2.26 110.867 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.8 t -69.68 -35.77 75.4 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.646 -0.501 . . . . 1.19 109.646 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 77.5 mt -66.58 -43.36 90.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.737 -0.665 . . . . 0.55 110.108 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.19 -50.79 72.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.305 -0.861 . . . . 0.57 111.148 176.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.77 82.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.5 110.773 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 33' ' ' LEU . 10.8 mt -68.59 -37.56 79.92 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 115.646 -0.706 . . . . 0.45 111.376 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -61.56 -38.96 89.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.003 0.43 . . . . 1.22 110.825 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -69.54 -50.75 41.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 3.05 110.811 178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.586 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 12.5 mmtt -66.91 -43.81 82.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.8 -0.636 . . . . 1.48 112.32 -179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.2 m -149.86 97.17 3.47 Favored Pre-proline 0 C--N 1.315 -0.893 0 O-C-N 122.073 -0.392 . . . . 1.16 110.485 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -40.82 -56.13 1.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.86 3.04 . . . . 0.58 113.276 -171.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -61.57 -34.54 75.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.596 -1.184 . . . . 2.45 112.208 -177.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 mt -71.71 -40.54 69.4 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.698 0.761 . . . . 1.42 109.156 -176.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.631 ' O ' ' HB2' ' A' ' 64' ' ' GLU . . . -62.54 -35.08 91.27 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 114.35 -1.296 . . . . 0.37 111.526 175.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -69.24 -42.31 75.8 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.64 0.257 . . . . 0.48 110.34 174.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -55.37 -53.28 58.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.967 -0.561 . . . . 2.17 110.981 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.0 p -70.1 -30.93 45.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.154 -0.475 . . . . 1.12 111.15 -179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.631 ' HB2' ' O ' ' A' ' 60' ' ' GLY . 0.7 OUTLIER -62.24 -58.28 8.33 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.404 -0.362 . . . . 1.7 110.224 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.586 ' O ' ' HG3' ' A' ' 69' ' ' MET . 85.7 mttt -61.56 -38.79 88.8 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 121.388 0.614 . . . . 3.96 110.03 -176.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 70' ' ' VAL . 0.2 OUTLIER -64.77 -39.47 93.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.062 -0.972 . . . . 1.5 109.82 -179.023 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.8 t-80 -78.53 -29.24 46.34 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.77 -0.65 . . . . 2.34 109.292 -175.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.19 -39.82 95.74 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.086 -0.961 . . . . 0.4 111.321 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.586 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 20.2 mtm -64.93 -46.94 79.53 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.429 -0.582 . . . . 0.72 109.429 177.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.499 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 94.1 t -56.71 -42.61 77.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 CA-C-N 114.912 -1.04 . . . . 0.79 110.289 175.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -64.17 -38.87 92.6 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.798 -0.637 . . . . 1.47 110.811 177.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.9 t -56.89 -33.3 66.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.196 0.522 . . . . 1.26 110.382 177.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 69' ' ' MET . 65.4 mmtt -79.38 -49.63 12.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.6 -0.727 . . . . 1.54 110.441 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.1 mt -69.37 -25.89 30.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.126 0.488 . . . . 0.34 111.514 -176.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.51 -36.11 76.15 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.712 0.767 . . . . 0.35 109.698 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.47 2.82 52.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.527 -1.215 . . . . 0.49 110.536 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 132' ' ' PHE . 10.9 tp -93.33 134.23 35.75 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.567 -0.742 . . . . 0.71 109.321 -179.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.39 153.57 46.07 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.762 -0.732 . . . . 0.76 111.838 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -43.07 -38.62 7.49 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.85 3.034 . . . . 1.56 113.657 -178.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -63.06 -54.3 40.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.035 0.445 . . . . 2.52 110.315 -177.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.408 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -80.84 -28.09 36.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.817 -0.628 . . . . 0.36 110.936 -174.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 41.4 ttmt -55.32 -44.37 75.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.626 -0.715 . . . . 2.04 110.278 176.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 87' ' ' LYS . . . -59.98 -42.14 98.19 Favored Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.943 -0.646 . . . . 0.41 112.02 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -67.2 -43.87 81.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.742 0.306 . . . . 1.65 110.985 178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.19 -45.38 93.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.372 -0.376 . . . . 0.41 111.456 -177.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 82' ' ' LYS . 33.5 mt-10 -66.42 -23.25 66.27 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.274 -0.421 . . . . 1.96 111.045 -177.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' ' 83' ' ' GLY . 5.7 mptp? -87.68 -48.48 7.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.365 -0.38 . . . . 2.12 111.258 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 10.8 p -61.47 -39.55 91.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.637 0.256 . . . . 0.57 111.069 -176.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.6 mp -59.98 -45.04 95.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.32 -0.4 . . . . 1.09 110.866 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -72.2 -36.4 69.19 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.576 0.227 . . . . 2.82 111.323 -179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 95.0 mt -61.28 -52.2 64.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.878 0.371 . . . . 0.51 110.362 176.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.16 77.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.102 -0.499 . . . . 0.64 110.801 179.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -60.61 -42.5 96.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.036 -0.529 . . . . 4.42 110.89 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.17 -32.58 84.64 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.008 -0.615 . . . . 0.66 111.982 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.8 mm -61.4 -49.27 85.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.001 0.429 . . . . 0.55 110.55 179.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -94.93 21.46 7.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.148 0.499 . . . . 2.7 110.576 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -105.23 -34.91 7.74 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.533 -0.758 . . . . 0.63 109.047 168.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.506 ' HA ' ' OG1' ' A' ' 101' ' ' THR . 6.4 ptp180 -80.75 -15.85 55.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.946 -0.57 . . . . 3.1 109.61 175.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -65.26 -35.78 82.1 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.135 -0.691 . . . . 0.97 109.135 166.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.542 ' CD2' ' HE2' ' A' ' 37' ' ' PHE . 13.4 m-85 -75.27 -46.36 34.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.582 -0.735 . . . . 1.48 112.019 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 41.6 p -60.23 -21.82 62.28 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.865 0.691 . . . . 0.87 112.865 -175.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 104.16 29.41 5.46 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.844 -0.693 . . . . 1.16 111.957 -174.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -132.77 68.86 1.49 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.305 -0.628 . . . . 1.83 109.305 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.63 110.68 2.54 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-N 115.898 -0.592 . . . . 1.75 111.745 -176.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.45 ' HG3' ' HG3' ' A' ' 98' ' ' ARG . 78.2 Cg_exo -50.78 148.75 15.53 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.8 3.0 . . . . 0.53 113.772 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 10.1 t -88.61 168.76 12.28 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.788 -0.819 . . . . 1.48 108.788 172.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.7 tppt? -59.93 -38.39 82.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 118.403 0.547 . . . . 2.88 109.783 -176.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -64.03 -31.16 72.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.972 -1.013 . . . . 2.24 111.258 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -64.15 -44.41 92.2 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.239 0.542 . . . . 1.73 109.837 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 114' ' ' VAL . 9.8 mp -68.0 -44.73 75.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.82 110.789 177.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 107' ' ' LYS . 58.4 mtpt -54.66 -46.55 74.04 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.392 0.615 . . . . 1.74 110.133 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.74 -43.17 94.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.47 111.723 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -64.43 -39.17 93.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.977 0.362 . . . . 1.34 111.977 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.684 ' O ' HG22 ' A' ' 117' ' ' VAL . 4.3 m -76.74 -27.96 17.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.254 0 CA-C-O 121.671 0.748 . . . . 0.65 109.292 -178.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -62.13 -37.65 85.96 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.219 -0.9 . . . . 1.72 111.036 177.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.444 ' O ' HD13 ' A' ' 120' ' ' LEU . 8.7 tt0 -77.35 -34.55 55.11 Favored 'General case' 0 N--CA 1.434 -1.238 0 CA-C-N 116.453 -0.34 . . . . 2.27 111.147 -175.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.684 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.9 m -62.02 -34.59 64.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.562 -0.455 . . . . 0.81 109.91 171.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 11.0 mt -72.81 -34.13 66.68 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.281 -0.266 . . . . 1.21 110.281 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -59.85 -42.45 93.66 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.439 0.638 . . . . 0.95 109.344 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.444 HD13 ' O ' ' A' ' 116' ' ' GLU . 10.5 mp -73.58 -45.12 55.16 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.192 -0.913 . . . . 1.06 111.288 175.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -72.56 -30.75 64.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 119.99 -0.684 . . . . 1.54 111.893 -170.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.12 -35.79 81.43 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.006 0.432 . . . . 1.98 110.924 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -85.98 -4.68 59.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.896 0.702 . . . . 0.7 112.896 -173.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.408 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 55.3 mtm -75.0 154.41 38.07 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.425 -0.51 . . . . 0.5 110.902 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.8 m -64.02 140.63 58.89 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.269 -0.423 . . . . 1.18 110.446 176.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -52.64 -45.75 66.81 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.44 0.533 . . . . 2.21 112.44 -170.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.96 -32.47 70.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.421 . . . . 0.42 111.108 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -74.88 -34.2 53.5 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.484 -0.646 . . . . 0.31 111.484 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -67.37 -44.99 77.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.226 0.536 . . . . 1.32 110.371 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.19 -41.66 89.04 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.144 -0.935 . . . . 0.42 111.363 178.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -71.6 -26.65 62.68 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.05 -0.977 . . . . 0.55 110.407 -174.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.421 ' HA ' HD11 ' A' ' 77' ' ' LEU . 92.2 t80 -63.01 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.753 -0.658 . . . . 0.39 109.898 172.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -74.84 -5.45 74.85 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 121.045 -0.597 . . . . 0.27 112.92 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -94.41 -37.38 11.47 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.398 0.618 . . . . 2.43 109.874 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 75.1 mm-40 -90.79 -33.84 15.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.004 -0.998 . . . . 1.83 110.922 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.499 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 43.4 m-85 -133.38 72.57 74.85 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 0.69 110.471 174.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.93 -29.52 67.08 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.984 2.456 . . . . 0.63 111.774 -177.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -64.58 -39.3 93.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.465 -0.789 . . . . 2.31 111.029 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.6 mt -81.93 -40.18 22.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.522 -0.308 . . . . 1.02 110.605 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.66 70.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.115 0.483 . . . . 0.35 110.127 177.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -53.01 -69.59 0.11 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.373 -0.83 . . . . 2.58 111.088 172.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.581 HG21 HD22 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -60.19 -30.71 46.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 115.071 -0.968 . . . . 0.5 112.631 -174.504 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.418 ' CD1' HG22 ' A' ' 142' ' ' VAL . 16.3 m-30 -73.65 -47.08 42.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.149 -0.621 . . . . 0.62 110.726 -175.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -74.51 -30.86 61.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.558 -0.292 . . . . 2.58 111.639 -175.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 12.4 p -73.04 -16.35 61.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.09 0.471 . . . . 1.32 110.636 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . 0.41 ' O ' ' HD3' ' A' ' 150' ' ' LYS . . . 93.49 1.45 66.29 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.697 -0.763 . . . . 1.09 112.696 176.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -61.39 -45.67 93.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.616 0.246 . . . . 1.98 110.93 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 142' ' ' VAL . . . -66.17 -39.51 89.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.855 0.359 . . . . 0.34 110.132 176.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.32 -40.66 82.65 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.51 111.485 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 146' ' ' GLY . 11.7 mptt -75.19 -35.7 61.51 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 2.82 111.117 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 45.6 t80 -67.39 -35.43 79.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.099 0.476 . . . . 0.49 109.889 174.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.546 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -72.15 -33.8 68.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.586 -0.733 . . . . 0.59 111.216 178.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 89.12 25.57 28.59 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.619 -0.719 . . . . 1.62 112.758 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.449 ' CG ' ' H ' ' A' ' 155' ' ' ASN . 3.9 pt-20 -105.62 -111.96 0.27 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.546 0.573 . . . . 4.12 112.546 -176.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.449 ' H ' ' CG ' ' A' ' 154' ' ' GLU . 9.0 p30 . . . . . 0 C--O 1.25 1.116 0 CA-C-N 116.003 -0.544 . . . . 4.01 111.268 -174.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 19.1 mmt . . . . . 0 N--CA 1.482 1.154 0 CA-C-O 120.708 0.29 . . . . 23.59 110.611 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . 123.8 -25.51 6.15 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.72 -0.752 . . . . 22.47 112.25 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 18.2 p -111.24 30.55 6.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 21.51 111.242 -178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 26.9 m -67.04 -47.63 70.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.038 0.446 . . . . 20.19 109.843 178.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 15.5 p80 -95.07 136.05 35.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.959 -0.756 . . . . 21.42 108.959 174.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 61.97 90.5 0.07 Allowed 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.492 0.495 . . . . 18.2 110.027 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -47.81 117.07 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.591 -0.732 . . . . 16.06 111.808 -176.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -135.58 101.55 4.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.472 -0.785 . . . . 13.27 109.372 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -59.46 -43.31 93.23 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.476 -0.783 . . . . 12.33 111.911 -173.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -80.85 66.27 6.3 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.832 0.349 . . . . 11.33 110.907 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 5.8 m -137.23 -67.05 0.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.158 0.504 . . . . 7.95 110.373 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 16.6 m -124.26 -172.64 2.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.863 -0.608 . . . . 7.36 109.694 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . -66.41 98.51 0.39 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.084 -0.579 . . . . 4.57 112.639 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -130.26 82.38 2.06 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.626 -0.509 . . . . 4.52 109.626 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 75.9 mmm -76.58 130.71 38.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.283 0.563 . . . . 2.0 111.514 -176.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.618 ' CD2' ' HD3' ' A' ' 30' ' ' LYS . 0.9 OUTLIER -62.4 128.9 38.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.881 -1.054 . . . . 1.47 110.895 179.05 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . 33.8 mmtp -116.61 146.3 42.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.734 -0.666 . . . . 3.15 109.834 -178.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -74.47 -31.36 62.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.03 0.443 . . . . 2.35 109.941 -179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -75.99 -5.51 46.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.687 -0.688 . . . . 4.16 110.439 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 2' ' ' LYS . 20.9 t70 -95.46 -16.51 22.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.002 -0.545 . . . . 2.57 109.904 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.499 ' HB ' ' HD2' ' A' ' 11' ' ' ARG . 65.1 mt -70.31 137.72 86.6 Favored Pre-proline 0 C--O 1.236 0.353 0 N-CA-C 108.961 -0.755 . . . . 0.69 108.961 175.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -42.24 116.2 0.58 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.463 . . . . 0.6 112.111 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.94 -16.75 64.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.98 -0.555 . . . . 0.57 112.045 -173.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -75.14 -30.39 60.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.835 0.826 . . . . 1.37 109.68 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -82.95 -29.37 29.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.55 -1.205 . . . . 0.8 110.849 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.499 ' HD2' ' HB ' ' A' ' 6' ' ' ILE . 45.5 mtp180 -70.8 -17.42 62.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.49 0.662 . . . . 1.73 109.952 179.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -72.14 -22.88 61.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.872 -1.058 . . . . 1.02 110.612 176.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.419 ' CD2' ' HD2' ' A' ' 147' ' ' LYS . 85.2 mt -89.35 -12.28 40.9 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.191 -0.459 . . . . 0.93 111.182 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 66.1 mtt -75.82 124.64 88.7 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 116.428 -0.351 . . . . 1.15 110.801 -176.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.504 ' HD3' HD21 ' A' ' 139' ' ' LEU . 54.0 Cg_endo -71.99 153.36 57.86 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.566 2.177 . . . . 0.9 111.558 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -45.49 -53.88 5.04 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.593 2.862 . . . . 0.96 113.59 -173.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.583 ' O ' HD21 ' A' ' 66' ' ' LEU . 44.0 mt-10 -59.87 -38.12 81.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.749 0.309 . . . . 1.83 111.585 -178.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.58 -27.47 58.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.726 0.298 . . . . 0.82 111.1 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 23.0 mtm180 -73.83 -45.03 53.78 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.161 -0.472 . . . . 2.16 110.409 177.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -47.65 -44.87 27.39 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.112 0.883 . . . . 1.06 111.473 -172.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.405 ' O ' HD23 ' A' ' 25' ' ' LEU . 38.5 t80 -59.94 -67.27 0.4 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.022 -0.535 . . . . 0.65 111.632 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.545 HD21 ' OH ' ' A' ' 100' ' ' TYR . 24.1 mt -70.61 -11.04 60.68 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.74 1.155 . . . . 1.13 112.493 -177.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -66.65 -40.79 88.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.257 0.551 . . . . 2.06 109.769 163.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -74.7 -48.25 26.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.346 -0.843 . . . . 1.84 112.041 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.432 HD11 HD21 ' A' ' 59' ' ' LEU . 4.0 mm? -58.76 140.64 54.66 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.537 0.684 . . . . 1.05 111.852 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.2 p -139.94 -169.47 2.74 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.653 -1.158 . . . . 1.78 109.531 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.17 150.71 33.46 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.765 -0.457 . . . . 2.39 109.765 176.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.51 -53.8 4.38 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.501 -0.857 . . . . 0.93 111.322 -174.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.478 ' O ' HG12 ' A' ' 32' ' ' VAL . 16.2 m-20 -66.57 -44.78 81.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.523 0.677 . . . . 2.25 109.525 177.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.618 ' HD3' ' CD2' ' A' ' 1' ' ' PHE . 89.9 mttt -72.07 -12.58 61.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.321 -0.854 . . . . 1.31 110.664 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.6 m -76.46 -43.43 39.96 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.892 -0.594 . . . . 0.8 109.711 175.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.478 HG12 ' O ' ' A' ' 29' ' ' ASP . 5.0 p -79.36 -29.93 13.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 115.431 -0.804 . . . . 0.85 110.498 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.642 HD23 HD21 ' A' ' 52' ' ' LEU . 23.4 mt -56.18 -42.74 77.58 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.869 0.366 . . . . 0.98 110.768 171.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.555 ' O ' ' HG2' ' A' ' 38' ' ' LYS . 39.6 ttmt -54.56 -42.1 70.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.903 -0.59 . . . . 2.41 110.929 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.942 -0.572 . . . . 1.96 111.548 -176.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.0 t -86.86 -52.26 11.96 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.513 0.673 . . . . 0.98 109.564 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.532 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 47.5 m-85 -58.32 -50.47 73.52 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 115.223 1.564 . . . . 0.83 115.223 178.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 15.5 ptpt -86.54 18.04 3.53 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 119.42 -0.912 . . . . 2.18 111.729 -177.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.46 -78.67 0.59 Allowed 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.509 -0.768 . . . . 1.56 109.388 169.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.446 ' HA3' ' HA ' ' A' ' 41' ' ' PRO . . . 44.77 -151.37 0.75 Allowed Glycine 0 CA--C 1.525 0.683 0 C-N-CA 121.084 -0.579 . . . . 1.54 113.22 -175.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.446 ' HA ' ' HA3' ' A' ' 40' ' ' GLY . 9.3 Cg_endo -89.28 147.0 22.42 Favored 'Cis proline' 0 N--CA 1.455 -0.787 0 C-N-CA 123.986 -1.256 . . . . 1.68 111.318 -6.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.431 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 36.0 m-85 -118.02 114.05 22.57 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.775 -0.648 . . . . 1.28 110.566 -175.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HG3' HD22 ' A' ' 44' ' ' ASN . 13.4 ptmm? -73.19 -7.21 50.45 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.407 -0.815 . . . . 3.51 111.239 177.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.527 HD22 ' HG3' ' A' ' 43' ' ' LYS . 8.4 p30 -150.03 161.97 41.31 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.902 -0.407 . . . . 1.52 109.902 -178.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 49' ' ' ILE . 19.9 m -73.51 -28.01 61.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.289 -0.414 . . . . 1.18 110.86 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.419 ' HB2' ' OD1' ' A' ' 44' ' ' ASN . 38.2 mt-10 -59.51 -40.98 88.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 2.24 111.113 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.431 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 28.9 mt-10 -62.99 -35.17 79.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.738 0.304 . . . . 2.26 111.145 176.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.4 m -69.93 -40.84 75.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.156 0.503 . . . . 1.19 110.006 177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 45' ' ' THR . 76.2 mt -65.08 -42.72 95.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.594 -0.73 . . . . 0.55 110.212 177.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.64 -47.31 80.0 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.298 -0.864 . . . . 0.57 111.285 176.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.74 89.09 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.433 0.635 . . . . 0.5 110.258 178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.642 HD21 HD23 ' A' ' 33' ' ' LEU . 36.4 mt -69.86 -36.35 75.43 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 115.202 -0.908 . . . . 0.45 111.395 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -65.12 -30.24 71.16 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.926 -0.31 . . . . 1.22 111.147 176.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -75.0 -44.37 48.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.206 0.527 . . . . 3.05 110.402 176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.46 ' HB3' ' CG2' ' A' ' 32' ' ' VAL . 52.3 mmtt -68.71 -55.95 9.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.637 -0.711 . . . . 1.48 111.607 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 m -142.54 95.7 6.43 Favored Pre-proline 0 C--N 1.315 -0.93 0 N-CA-C 110.214 -0.291 . . . . 1.16 110.214 -178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.34 -59.61 0.8 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.96 3.107 . . . . 0.58 113.95 -171.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -66.88 -22.07 65.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.49 -0.777 . . . . 2.45 112.286 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.47 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 3.4 tt -73.85 -41.53 62.11 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.602 -1.258 . . . . 1.42 107.602 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -64.3 -33.11 86.36 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 114.264 -1.334 . . . . 0.37 111.311 174.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.47 ' O ' ' HG3' ' A' ' 65' ' ' LYS . . . -65.42 -39.86 92.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.796 0.331 . . . . 0.48 110.272 173.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 59' ' ' LEU . 16.5 tppt? -57.0 -57.42 12.64 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.638 -0.71 . . . . 2.17 110.916 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 8.1 p -63.48 -35.65 73.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.327 -0.397 . . . . 1.12 111.246 -179.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.26 -64.66 0.81 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.228 -0.442 . . . . 1.7 111.458 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HD3' ' N ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -64.55 -32.12 73.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.251 0.548 . . . . 3.96 110.788 -173.016 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.583 HD21 ' O ' ' A' ' 17' ' ' GLU . 3.4 tm? -67.29 -46.54 73.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.389 -0.823 . . . . 1.5 110.143 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -24.74 57.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.911 -0.774 . . . . 2.34 108.911 -175.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.92 -37.67 81.94 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.923 -1.035 . . . . 0.4 111.804 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.5 ' O ' ' HG2' ' A' ' 73' ' ' LYS . 34.6 mtm -65.08 -50.73 65.0 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 109.321 -0.622 . . . . 0.72 109.321 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.482 HG13 ' HZ ' ' A' ' 136' ' ' PHE . 89.0 t -53.7 -43.62 55.89 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.525 0 CA-C-N 114.795 -1.093 . . . . 0.79 110.238 174.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -60.82 -40.17 91.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.311 -0.859 . . . . 1.47 110.683 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.8 m -63.3 -39.31 94.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.641 0.258 . . . . 1.26 111.048 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 69' ' ' MET . 32.9 mmtp -66.64 -43.87 83.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.548 -0.296 . . . . 1.54 110.225 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.487 ' CG2' ' HG3' ' A' ' 82' ' ' LYS . 77.9 mt -72.51 -23.44 21.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.242 0.544 . . . . 0.34 111.021 178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.14 -30.44 67.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.584 0.707 . . . . 0.35 110.184 173.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -92.85 2.91 56.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.863 -1.062 . . . . 0.49 110.761 -178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.505 HD13 ' CG ' ' A' ' 135' ' ' GLN . 11.5 tp -95.76 132.67 40.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.715 -0.675 . . . . 0.71 110.378 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.86 151.24 49.56 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.894 -0.67 . . . . 0.76 112.061 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -41.07 -42.83 4.84 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 124.075 3.183 . . . . 1.56 114.312 -176.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -60.53 -51.7 68.32 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.417 0.627 . . . . 2.52 110.305 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.533 ' HA ' ' SD ' ' A' ' 124' ' ' MET . . . -81.63 -30.74 32.71 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.146 -0.934 . . . . 0.36 110.646 -173.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HG3' ' CG2' ' A' ' 74' ' ' ILE . 27.7 ttpp -59.3 -44.59 92.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.552 -0.749 . . . . 2.04 110.518 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.68 -41.68 90.23 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.683 -0.77 . . . . 0.41 111.436 178.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -67.12 -48.84 66.91 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.662 -0.269 . . . . 1.65 111.225 175.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -55.28 -45.6 76.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.167 0.508 . . . . 0.41 111.388 -177.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.647 ' O ' ' HG3' ' A' ' 90' ' ' GLU . 38.8 mt-10 -67.83 -43.37 79.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.711 -0.677 . . . . 1.96 110.419 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -66.35 -44.04 84.39 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.731 0.301 . . . . 2.12 111.301 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 16.2 p -62.77 -41.48 99.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.347 -0.388 . . . . 0.57 110.914 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.649 ' O ' ' HG3' ' A' ' 93' ' ' ARG . 28.8 mt -64.59 -39.77 86.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-N 116.376 -0.374 . . . . 1.09 110.843 177.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.647 ' HG3' ' O ' ' A' ' 86' ' ' GLU . 47.3 mt-10 -52.97 -44.26 67.02 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.969 0.414 . . . . 2.82 110.646 176.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 48.3 mt -69.55 -44.25 79.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.827 -0.624 . . . . 0.51 110.753 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.95 -22.55 64.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.64 111.28 -178.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 89' ' ' ILE . 39.2 mtm180 -63.41 -50.25 70.59 Favored 'General case' 0 C--O 1.222 -0.353 0 N-CA-C 109.803 -0.443 . . . . 4.42 109.803 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.96 -35.76 92.41 Favored Glycine 0 N--CA 1.453 -0.219 0 CA-C-N 115.961 -0.563 . . . . 0.66 113.185 -172.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.3 mm -62.4 -49.44 83.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.991 0.424 . . . . 0.55 110.664 -178.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -94.89 7.02 47.33 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.373 -0.376 . . . . 2.7 111.033 -179.095 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -86.24 -30.83 22.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.218 -0.66 . . . . 0.63 109.218 167.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.519 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 61.1 mtp180 -83.24 -7.72 59.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.749 -0.66 . . . . 3.1 109.404 174.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.471 ' CE1' ' HD2' ' A' ' 105' ' ' PRO . 8.4 m-85 -80.05 -26.13 39.84 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.084 -0.71 . . . . 0.97 109.084 166.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.545 ' OH ' HD21 ' A' ' 22' ' ' LEU . 23.1 m-85 -80.14 -49.26 11.95 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 116.131 -0.486 . . . . 1.48 110.723 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.534 ' HA ' ' HG3' ' A' ' 34' ' ' LYS . 55.1 p -63.97 -22.33 66.88 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.756 -0.656 . . . . 0.87 112.501 -174.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 99.47 11.1 45.71 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.7 -0.762 . . . . 1.16 112.715 -176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.519 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 58.1 t30 -111.35 66.85 0.63 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.675 -0.491 . . . . 1.83 109.675 179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -53.77 123.21 37.66 Favored Pre-proline 0 N--CA 1.464 0.229 0 CA-C-N 115.259 -0.882 . . . . 1.75 112.35 -172.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.471 ' HD2' ' CE1' ' A' ' 99' ' ' TYR . 44.9 Cg_endo -69.48 155.04 67.98 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.985 2.457 . . . . 0.53 111.995 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.455 ' O ' HD13 ' A' ' 110' ' ' LEU . 80.6 p -83.79 173.92 10.88 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.933 -0.395 . . . . 1.48 109.933 176.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -65.08 -27.67 68.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.236 0.541 . . . . 2.88 109.807 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -72.8 -29.58 63.38 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.877 -0.601 . . . . 2.24 110.225 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -61.71 -44.1 97.58 Favored 'General case' 0 CA--C 1.523 -0.091 0 CA-C-O 121.292 0.567 . . . . 1.73 109.642 170.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 106' ' ' THR . 7.0 mp -65.18 -45.13 86.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.328 -0.851 . . . . 0.82 110.939 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -58.38 -42.02 86.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.173 0.511 . . . . 1.74 110.127 177.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 115' ' ' LYS . . . -63.5 -42.94 98.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.721 -0.672 . . . . 0.47 111.412 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.498 ' O ' HG13 ' A' ' 117' ' ' VAL . 77.5 p -63.26 -34.98 78.85 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.771 -0.372 . . . . 1.34 111.964 -178.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.611 ' O ' HG22 ' A' ' 117' ' ' VAL . 5.5 m -87.1 -27.3 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-O 121.221 0.534 . . . . 0.65 110.537 -175.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 112' ' ' ALA . 14.6 ptpt -71.07 -30.63 66.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.167 -0.47 . . . . 1.72 110.973 -179.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.61 ' O ' HD23 ' A' ' 120' ' ' LEU . 21.0 mt-10 -77.5 -36.19 52.8 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 119.839 -0.744 . . . . 2.27 110.63 179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.611 HG22 ' O ' ' A' ' 114' ' ' VAL . 3.2 m -66.41 -28.15 42.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 120.287 -0.565 . . . . 0.81 109.68 175.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.482 ' CD1' ' HA ' ' A' ' 149' ' ' ALA . 75.3 mt -73.92 -38.97 64.14 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.637 -0.505 . . . . 1.21 109.637 173.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -58.65 -49.2 78.42 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 109.438 -0.579 . . . . 0.95 109.438 177.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.61 HD23 ' O ' ' A' ' 116' ' ' GLU . 4.4 mm? -61.43 -46.81 88.54 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.662 -0.699 . . . . 1.06 112.052 173.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -32.12 64.51 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 118.513 -1.275 . . . . 1.54 111.862 -171.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.079 0.466 . . . . 1.98 110.654 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -79.51 -11.2 59.9 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.698 . . . . 0.7 112.577 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.533 ' SD ' ' HA ' ' A' ' 81' ' ' ALA . 60.6 mtm -72.71 151.03 42.4 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 119.662 -0.815 . . . . 0.5 110.042 -177.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 8.3 p -63.43 150.32 43.9 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.145 -0.317 . . . . 1.18 110.145 173.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -55.55 -43.29 75.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.557 0.218 . . . . 2.21 111.501 -173.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -61.31 -25.15 66.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.137 -0.483 . . . . 0.42 111.464 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -80.46 -36.1 24.34 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.87 -0.681 . . . . 0.31 111.646 177.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.478 ' HE3' ' O ' ' A' ' 124' ' ' MET . 98.5 mttt -63.14 -45.92 89.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.211 0.529 . . . . 1.32 110.502 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.529 ' O ' ' HE3' ' A' ' 134' ' ' LYS . . . -66.89 -33.85 76.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.544 -0.753 . . . . 0.42 111.335 -178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -74.79 -32.26 61.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.914 0.388 . . . . 0.55 110.049 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.47 -32.36 71.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.968 -0.56 . . . . 0.39 110.088 172.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -67.14 -18.65 69.35 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.889 -0.596 . . . . 0.27 113.067 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.529 ' HE3' ' O ' ' A' ' 130' ' ' ALA . 23.2 mmtp -82.8 -29.37 29.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.468 0.651 . . . . 2.43 110.065 -179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.505 ' CG ' HD13 ' A' ' 77' ' ' LEU . 6.2 mm100 -96.23 -40.8 8.99 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.041 -0.981 . . . . 1.83 110.976 -174.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.482 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 70.5 m-85 -131.18 74.1 79.74 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 120.984 0.421 . . . . 0.69 109.958 176.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -62.8 -34.55 72.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.104 2.536 . . . . 0.63 112.621 -174.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.553 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 47.8 t80 -64.58 -34.34 78.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.884 0.373 . . . . 2.31 110.616 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.512 ' HB3' ' CE2' ' A' ' 143' ' ' PHE . 86.6 mt -78.84 -47.43 16.63 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.845 -0.342 . . . . 1.02 110.375 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -57.03 -33.62 67.38 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.185 0.516 . . . . 0.35 109.777 177.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.553 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 59.8 tttp -51.09 -73.37 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.89 -1.05 . . . . 2.58 111.525 171.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.538 HG23 ' HB2' ' A' ' 148' ' ' ALA . 1.1 m -72.17 -13.76 16.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 115.346 -0.843 . . . . 0.5 112.91 -171.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 139' ' ' LEU . 21.2 m-30 -80.21 -44.81 19.1 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.41 -0.516 . . . . 0.62 110.259 175.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.84 -43.05 84.74 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-N 115.861 -0.609 . . . . 2.58 110.386 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.4 m -76.85 156.83 31.9 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 108.96 -0.755 . . . . 1.32 108.96 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . -79.28 48.74 3.43 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.509 -0.853 . . . . 1.09 112.763 -176.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.419 ' HD2' ' CD2' ' A' ' 13' ' ' LEU . 1.7 tmtp? -100.64 -65.87 0.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.123 -0.325 . . . . 1.98 110.123 -178.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . 0.538 ' HB2' HG23 ' A' ' 142' ' ' VAL . . . -64.86 -38.38 90.8 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.061 0.458 . . . . 0.34 109.86 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.482 ' HA ' ' CD1' ' A' ' 118' ' ' LEU . . . -55.55 -44.73 77.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.292 -0.867 . . . . 0.51 110.763 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.05 -38.14 82.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.411 -0.359 . . . . 2.82 110.269 -179.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 25.8 t80 -58.43 -41.85 85.98 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 0.49 110.255 177.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.584 ' HB2' HG23 ' A' ' 114' ' ' VAL . . . -71.47 -27.99 63.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.741 -0.663 . . . . 0.59 111.769 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 110.46 -11.01 30.76 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.314 -0.714 . . . . 1.62 111.314 -175.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 149' ' ' ALA . 18.6 mt-10 68.52 146.23 0.05 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 122.072 0.939 . . . . 4.12 112.451 179.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-N 114.637 -1.165 . . . . 4.01 109.824 -179.365 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -14' ' ' MET . . . . . . . . . . . . . 87.2 mtp . . . . . 0 N--CA 1.48 1.044 0 CA-C-O 120.732 0.301 . . . . 23.59 110.261 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -13' ' ' GLY . . . . . . . . . . . . . . . -113.38 162.14 12.46 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.089 -0.576 . . . . 22.47 111.89 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -12' ' ' SER . . . . . . . . . . . . . 38.7 m -78.41 123.61 27.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.94 0.4 . . . . 21.51 110.57 179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -11' ' ' SER . . . . . . . . . . . . . 26.8 p -79.03 110.64 14.46 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.089 -0.505 . . . . 20.19 111.054 -177.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -10' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -87.79 -22.5 24.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.361 0.6 . . . . 21.42 109.455 174.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -9' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -106.18 104.94 14.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.335 -0.848 . . . . 18.2 109.349 175.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -8' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -97.2 82.79 3.22 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.548 -0.296 . . . . 16.06 111.354 -175.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -7' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -156.7 71.45 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.347 0.594 . . . . 13.27 109.745 176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -6' ' ' HIS . . . . . . . . . . . . . 28.5 t-80 -87.85 -49.03 7.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.66 -0.7 . . . . 12.33 110.923 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' HIS . . . . . . . . . . . . . 40.2 t-80 -138.84 -60.12 0.59 Allowed 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.627 -0.429 . . . . 11.33 111.701 -176.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 22.6 t -134.49 123.53 24.1 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.878 0.37 . . . . 7.95 111.491 -175.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 34.9 m -88.0 -32.61 18.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.919 -0.582 . . . . 7.36 109.657 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . 168.07 35.65 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.594 -0.812 . . . . 4.57 112.962 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -87.47 151.86 22.69 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.667 -0.494 . . . . 4.52 109.667 177.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' MET . . . . . . . . . . . . . 8.4 tpt -108.23 138.74 44.0 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.06 0.457 . . . . 2.0 111.322 -174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -56.38 124.55 18.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 114.836 -1.075 . . . . 1.47 112.444 -177.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -104.89 135.06 46.94 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.348 -0.842 . . . . 3.15 109.704 176.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -64.35 -39.93 94.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.08 -0.963 . . . . 2.35 112.621 -168.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -93.67 18.59 9.88 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.18 0.514 . . . . 4.16 111.131 -177.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -98.44 0.87 46.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.951 0.881 . . . . 2.57 109.092 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 63.9 mt -81.9 131.93 55.66 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.946 -1.025 . . . . 0.69 109.169 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.83 114.79 0.57 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.304 2.67 . . . . 0.6 112.349 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.65 66.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.772 -0.649 . . . . 0.57 111.481 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -65.21 -34.92 79.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.9 0.857 . . . . 1.37 109.697 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 151' ' ' PHE . 90.7 t80 -82.81 -33.36 27.25 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.447 -1.252 . . . . 0.8 110.369 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.543 ' HA ' ' SD ' ' A' ' 14' ' ' MET . 41.1 mtp85 -64.2 -24.86 67.83 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.324 0.583 . . . . 1.73 110.26 -178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -63.64 -27.02 68.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.02 110.866 176.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.2 mt -94.23 -19.25 20.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.068 -0.515 . . . . 0.93 110.971 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 11' ' ' ARG . 91.5 mtp -65.73 131.29 94.68 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.931 -0.577 . . . . 1.15 111.653 -174.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 33.5 Cg_exo -60.51 137.1 71.71 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.657 2.238 . . . . 0.9 111.363 176.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 15' ' ' PRO . 78.3 Cg_exo -52.02 -31.24 43.35 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.618 2.878 . . . . 0.96 112.916 -178.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -62.56 -49.5 75.06 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.075 0.464 . . . . 1.83 110.541 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.06 -24.08 65.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.007 -0.542 . . . . 0.82 110.909 -178.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.7 mtp180 -78.56 -44.38 24.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.786 -0.643 . . . . 2.16 111.307 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 23' ' ' GLN . 32.2 t70 -51.71 -49.47 62.42 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.46 0.475 . . . . 1.06 112.195 -176.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' HB2' HD22 ' A' ' 66' ' ' LEU . 54.1 t80 -55.93 -58.49 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.378 -0.374 . . . . 0.65 111.728 177.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 25' ' ' LEU . 80.1 mt -72.55 -13.11 61.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 118.894 0.77 . . . . 1.13 111.329 -178.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 20' ' ' ASP . 51.7 tt0 -65.01 -49.47 70.07 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 120.688 0.28 . . . . 2.06 110.957 167.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -86.84 -30.79 21.2 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.992 0.367 . . . . 1.84 111.992 -175.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.744 HD23 HD23 ' A' ' 22' ' ' LEU . 14.9 tp -67.54 131.25 45.29 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-O 121.328 0.585 . . . . 1.05 110.407 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.54 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 14.2 t -119.22 168.6 10.73 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.414 -0.812 . . . . 1.78 110.011 -172.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.516 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 0.8 OUTLIER -54.66 -44.4 73.25 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.335 0.865 . . . . 2.39 113.335 -169.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -56.83 -38.33 83.1 Favored Glycine 0 N--CA 1.454 -0.156 0 C-N-CA 120.833 -0.699 . . . . 0.93 111.938 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.63 ' O ' HG12 ' A' ' 32' ' ' VAL . 49.7 m-20 -79.61 -38.63 33.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.433 0.159 . . . . 2.25 110.626 177.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 26' ' ' SER . 82.1 mttt -54.65 -27.95 43.55 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.152 0.501 . . . . 1.31 110.237 176.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.404 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 74.7 m -59.36 -36.33 75.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.425 -0.807 . . . . 0.8 111.522 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.63 HG12 ' O ' ' A' ' 29' ' ' ASP . 6.1 p -89.22 -24.58 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 CA-C-N 116.211 -0.45 . . . . 0.85 110.794 -174.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.64 HD13 HD21 ' A' ' 52' ' ' LEU . 4.3 mm? -50.2 -52.01 39.28 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.345 -0.389 . . . . 0.98 111.318 173.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' TYR . 46.2 pttt -66.19 -21.22 66.31 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.107 0.41 . . . . 2.41 112.107 -176.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -70.71 -27.99 64.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.159 0.504 . . . . 1.96 110.184 176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 96.5 t -78.96 -51.89 16.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.624 0.726 . . . . 0.98 109.967 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.54 ' HD1' ' O ' ' A' ' 33' ' ' LEU . 49.7 m-85 -60.71 -45.76 92.99 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.899 1.444 . . . . 0.83 114.899 179.214 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -73.9 -20.95 60.24 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 120.012 -0.675 . . . . 2.18 110.504 -177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -74.23 -76.6 0.13 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.903 -0.59 . . . . 1.56 109.907 172.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.405 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 48.32 -158.38 0.83 Allowed Glycine 0 CA--C 1.52 0.355 0 C-N-CA 121.077 -0.582 . . . . 1.54 112.693 -176.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -95.03 138.01 5.9 Favored 'Cis proline' 0 N--CA 1.452 -0.937 0 C-N-CA 124.184 -1.173 . . . . 1.68 111.175 -9.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 47' ' ' GLU . 41.7 m-85 -114.27 108.18 16.59 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.56 0.695 . . . . 1.28 110.916 -173.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -66.45 -8.93 29.33 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.435 -1.257 . . . . 3.51 111.0 175.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -137.79 163.54 31.11 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.617 -0.883 . . . . 1.52 108.617 -173.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 18.9 m -85.33 -33.29 22.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.797 0.332 . . . . 1.18 110.379 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.449 ' HA ' HD12 ' A' ' 49' ' ' ILE . 6.1 mp0 -56.61 -34.28 67.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.952 -0.567 . . . . 2.24 111.702 179.343 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HB3' ' CD1' ' A' ' 42' ' ' TYR . 0.6 OUTLIER -68.57 -38.07 80.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.74 0.305 . . . . 2.26 111.242 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.5 m -66.52 -39.34 88.57 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.507 -0.553 . . . . 1.19 109.507 174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 64' ' ' GLU . 97.0 mt -61.79 -44.66 99.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.254 -0.885 . . . . 0.55 110.108 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.77 -48.69 80.68 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.57 111.861 176.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.48 87.36 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.304 0.573 . . . . 0.5 110.214 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.64 HD21 HD13 ' A' ' 33' ' ' LEU . 29.0 mt -66.49 -38.06 86.44 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.184 -0.916 . . . . 0.45 111.331 178.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -62.27 -39.44 92.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.838 0.351 . . . . 1.22 111.547 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -71.24 -44.62 64.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.41 -0.359 . . . . 3.05 111.123 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.54 ' HB3' HG21 ' A' ' 32' ' ' VAL . 25.3 mmtt -68.73 -48.79 62.9 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.125 -0.489 . . . . 1.48 111.931 177.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.2 m -145.4 96.9 4.78 Favored Pre-proline 0 C--N 1.313 -1.004 0 O-C-N 122.234 -0.291 . . . . 1.16 110.502 -179.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -41.8 -56.79 1.74 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.809 3.006 . . . . 0.58 113.209 -170.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.475 ' HG2' ' HE3' ' A' ' 62' ' ' LYS . 37.0 tt0 -60.21 -35.41 75.36 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 114.533 -1.212 . . . . 2.45 112.436 -177.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 29' ' ' ASP . 62.1 mt -69.6 -40.61 76.56 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 119.406 -0.917 . . . . 1.42 109.05 -175.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.403 ' HA2' HG12 ' A' ' 63' ' ' VAL . . . -63.73 -38.43 96.18 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 114.311 -1.313 . . . . 0.37 111.691 176.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.88 -39.9 95.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.745 0.307 . . . . 0.48 110.49 176.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HE3' ' HG2' ' A' ' 58' ' ' GLU . 98.7 mttt -62.45 -58.73 6.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.013 -0.539 . . . . 2.17 110.913 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.403 HG12 ' HA2' ' A' ' 60' ' ' GLY . 11.5 p -62.88 -28.34 44.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 1.12 111.425 -177.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.525 ' HA ' HD13 ' A' ' 49' ' ' ILE . 38.3 tt0 -67.0 -57.73 6.3 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 121.011 -0.276 . . . . 1.7 111.016 178.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' MET . 0.1 OUTLIER -64.67 -31.19 72.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.619 0.723 . . . . 3.96 109.706 -175.468 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.562 HD22 ' HB2' ' A' ' 21' ' ' PHE . 21.5 tp -67.79 -38.15 82.95 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.707 -1.133 . . . . 1.5 110.49 177.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -79.36 -31.65 43.02 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.974 -0.75 . . . . 2.34 108.974 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.42 95.45 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.851 -1.068 . . . . 0.4 111.138 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 43.9 mtm -58.79 -55.72 31.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.892 -0.41 . . . . 0.72 109.892 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 66' ' ' LEU . 95.2 t -50.93 -46.82 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 115.366 -0.834 . . . . 0.79 110.949 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.457 ' HE2' ' HB3' ' A' ' 71' ' ' LYS . 12.8 mtpt -66.17 -33.92 76.86 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 115.662 -0.699 . . . . 1.47 112.308 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 44.4 t -56.6 -41.56 77.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.086 0.47 . . . . 1.26 110.649 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 135' ' ' GLN . 3.9 mptp? -69.6 -45.33 68.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.963 -0.562 . . . . 1.54 110.061 177.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.1 mt -67.94 -25.27 31.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 121.221 0.534 . . . . 0.34 110.889 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.27 -33.77 73.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.709 0.766 . . . . 0.35 109.939 173.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -87.01 -1.94 58.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.741 -1.118 . . . . 0.49 110.83 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.9 tp -93.95 137.97 32.58 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.731 -0.668 . . . . 0.71 109.894 -175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.97 149.28 51.46 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.393 -0.67 . . . . 0.76 112.037 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -37.95 -42.85 1.48 Allowed 'Trans proline' 0 N--CA 1.478 0.603 0 C-N-CA 124.666 3.577 . . . . 1.56 114.741 -176.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -70.14 -51.37 31.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.552 0.215 . . . . 2.52 110.683 -177.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.49 -33.46 69.28 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.711 0.767 . . . . 0.36 109.825 -177.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -57.2 -45.92 83.33 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.401 -1.272 . . . . 2.04 110.927 174.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.67 -43.24 97.93 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.654 -0.784 . . . . 0.41 111.738 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.526 ' CZ ' ' HB2' ' A' ' 121' ' ' TYR . 6.5 t80 -62.49 -48.02 81.43 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.359 -0.237 . . . . 1.65 110.359 175.503 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.691 ' O ' HG12 ' A' ' 89' ' ' ILE . . . -56.83 -56.95 14.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.274 . . . . 0.41 111.385 -178.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 90' ' ' GLU . 30.3 mt-10 -62.7 -25.13 68.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.408 -0.36 . . . . 1.96 111.408 -174.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.451 ' O ' HG13 ' A' ' 91' ' ' ILE . 53.5 tttp -86.75 -41.46 14.11 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.641 -0.254 . . . . 2.12 111.05 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.8 p -66.75 -39.47 87.92 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.683 -0.235 . . . . 0.57 111.158 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.691 HG12 ' O ' ' A' ' 85' ' ' ALA . 51.7 mm -58.12 -40.14 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 110.077 -0.342 . . . . 1.09 110.077 176.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 86' ' ' GLU . 75.5 mm-40 -63.61 -34.49 77.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.11 -0.495 . . . . 2.82 111.246 179.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 87' ' ' LYS . 53.2 mt -65.82 -49.6 76.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.777 0.323 . . . . 0.51 110.482 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 96' ' ' LYS . . . -67.92 -36.01 79.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.683 -0.488 . . . . 0.64 109.683 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -56.91 -40.62 76.62 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.468 -0.787 . . . . 4.42 110.763 175.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -68.86 -36.47 82.03 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.899 -0.667 . . . . 0.66 112.46 -179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.608 HG21 HD23 ' A' ' 110' ' ' LEU . 45.4 mm -67.62 -49.59 68.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.256 0.551 . . . . 0.55 110.071 178.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 92' ' ' ALA . 14.7 ptmm? -80.68 2.37 26.18 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 2.7 111.131 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.66 -26.37 27.83 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.89 -0.782 . . . . 0.63 108.89 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 103' ' ' ASN . 71.1 mtp180 -86.86 -1.56 57.89 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 3.1 109.866 174.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -90.84 -22.11 21.13 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.909 -0.404 . . . . 0.97 109.909 165.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.564 ' O ' ' HB3' ' A' ' 34' ' ' LYS . 30.8 m-85 -84.82 -45.04 12.72 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.96 0.409 . . . . 1.48 110.731 176.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.57 ' OG1' ' HA ' ' A' ' 98' ' ' ARG . 16.7 p -70.17 -20.97 63.1 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 113.005 0.743 . . . . 0.87 113.005 -176.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 98.28 1.47 58.07 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.762 -0.733 . . . . 1.16 112.789 -174.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.625 ' O ' ' HB3' ' A' ' 98' ' ' ARG . 51.3 m-80 -92.64 56.97 2.8 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 122.706 -0.29 . . . . 1.83 110.732 -178.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -43.72 123.21 3.81 Favored Pre-proline 0 N--CA 1.469 0.476 0 O-C-N 124.128 0.893 . . . . 1.75 112.374 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.0 155.52 38.4 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.946 2.431 . . . . 0.53 112.177 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.5 t -94.17 177.95 5.8 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.96 -0.756 . . . . 1.48 108.96 173.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 111' ' ' LYS . 9.0 ptpp? -62.77 -31.14 72.04 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.036 -0.666 . . . . 2.88 110.86 -175.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -61.81 -38.28 87.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.605 -0.271 . . . . 2.24 110.777 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -63.54 -45.0 92.55 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.28 0.562 . . . . 1.73 110.3 176.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.608 HD23 HG21 ' A' ' 95' ' ' ILE . 40.4 mt -67.24 -41.93 84.83 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.296 -0.865 . . . . 0.82 110.895 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 115' ' ' LYS . 59.1 mtpt -60.98 -41.75 97.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.973 0.416 . . . . 1.74 110.021 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -64.55 -39.44 93.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.939 -0.573 . . . . 0.47 111.291 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 117' ' ' VAL . 73.7 p -66.28 -33.6 76.11 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.392 0.515 . . . . 1.34 112.392 -177.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.58 ' O ' HG22 ' A' ' 117' ' ' VAL . 6.2 m -85.85 -25.81 6.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.868 0.842 . . . . 0.65 109.404 -179.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 111' ' ' LYS . 10.3 ttpt -61.5 -46.11 91.37 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.589 -1.187 . . . . 1.72 111.405 -178.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.491 ' O ' HD13 ' A' ' 120' ' ' LEU . 28.1 mt-10 -73.01 -33.88 66.03 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.666 -0.414 . . . . 2.27 111.793 -176.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 114' ' ' VAL . 2.5 m -64.13 -34.67 70.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.235 -0.586 . . . . 0.81 110.457 178.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.43 ' CD2' ' HB2' ' A' ' 149' ' ' ALA . 5.0 mp -76.79 -30.01 56.26 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.281 -0.568 . . . . 1.21 110.471 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' A' ' 155' ' ' ASN . 37.8 ttpt -62.07 -38.21 87.92 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.168 -0.679 . . . . 0.95 109.168 178.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 116' ' ' GLU . 11.1 mp -76.74 -47.5 21.61 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.234 -0.894 . . . . 1.06 111.925 174.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.526 ' HB2' ' CZ ' ' A' ' 84' ' ' PHE . 12.9 t80 -72.76 -39.48 66.76 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.469 -0.493 . . . . 1.54 111.938 -168.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -65.42 -36.66 84.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.368 0.604 . . . . 1.98 110.142 178.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -74.57 -2.1 24.43 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 114.7 -1.136 . . . . 0.7 112.99 -176.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 74.0 mtm -78.63 153.05 31.39 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 108.494 -0.928 . . . . 0.5 108.494 174.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 13.7 m -53.43 -79.4 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.402 0.546 . . . . 1.18 111.083 -176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.502 ' HA ' ' HG2' ' A' ' 129' ' ' LYS . 24.0 t70 -168.78 -47.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.358 -0.214 . . . . 2.21 110.956 175.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.33 -34.56 74.0 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.264 -0.425 . . . . 0.42 110.855 -179.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -76.18 -40.75 28.45 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.444 -0.798 . . . . 0.31 112.685 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.502 ' HG2' ' HA ' ' A' ' 126' ' ' ASP . 4.5 ptpp? -70.81 -35.96 72.76 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.345 -0.542 . . . . 1.32 110.528 -177.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -72.94 -23.43 60.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.951 0.405 . . . . 0.42 110.699 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.469 ' HA ' ' HE3' ' A' ' 134' ' ' LYS . 35.6 t70 -78.86 -32.33 45.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.02 -0.536 . . . . 0.55 109.653 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -61.39 -28.26 69.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.491 -0.777 . . . . 0.39 109.855 173.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -68.39 -16.73 69.68 Favored Glycine 0 N--CA 1.449 -0.47 0 CA-C-N 115.833 -0.621 . . . . 0.27 113.211 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.469 ' HE3' ' HA ' ' A' ' 131' ' ' ASP . 64.8 mttt -86.34 -40.31 15.58 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 121.628 0.728 . . . . 2.43 109.643 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 1.8 mp0 -78.44 -43.45 27.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.753 -1.112 . . . . 1.83 111.281 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' PHE . . . . . 0.444 ' HZ ' HG13 ' A' ' 70' ' ' VAL . 65.7 m-85 -128.1 77.32 76.89 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.69 110.025 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.36 -36.5 44.71 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.319 2.68 . . . . 0.63 113.333 -172.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' PHE . . . . . 0.576 ' O ' ' HB3' ' A' ' 141' ' ' LYS . 52.3 t80 -62.41 -40.77 97.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.43 -0.35 . . . . 2.31 111.373 -175.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 143' ' ' PHE . 92.2 mt -75.2 -45.6 39.41 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.855 -0.338 . . . . 1.02 110.651 -178.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.88 71.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.35 110.291 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 138' ' ' PHE . 86.9 tttt -52.42 -72.08 0.06 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 2.58 111.175 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.575 ' HB ' ' CB ' ' A' ' 147' ' ' LYS . 2.4 m -64.56 -31.71 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 115.195 -0.911 . . . . 0.5 113.004 -171.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 139' ' ' LEU . 21.3 m-30 -63.88 -29.05 70.27 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.983 0.421 . . . . 0.62 110.92 -177.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -91.19 -12.19 36.09 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.101 -0.499 . . . . 2.58 111.558 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 26.4 t -118.24 46.88 1.7 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.19 0.519 . . . . 1.32 110.098 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 69.68 -99.6 0.68 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.9 -0.667 . . . . 1.09 111.607 -178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.575 ' CB ' ' HB ' ' A' ' 142' ' ' VAL . 31.2 mmtm 48.12 -95.54 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.145 0 N-CA-C 113.064 0.764 . . . . 1.98 113.064 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -63.65 -38.24 90.38 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.054 0.454 . . . . 0.34 110.395 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 118' ' ' LEU . . . -64.1 -43.14 96.28 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.754 -0.657 . . . . 0.51 110.295 176.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -66.26 -35.87 81.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.241 0.543 . . . . 2.82 110.176 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.423 ' CZ ' ' HB2' ' A' ' 10' ' ' TYR . 56.6 t80 -62.29 -38.11 88.11 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.345 -0.843 . . . . 0.49 110.722 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.425 ' HB2' ' CG2' ' A' ' 114' ' ' VAL . . . -94.01 6.25 49.11 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.734 -0.666 . . . . 0.59 111.985 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 97.15 -66.12 0.91 Allowed Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 109.945 -1.262 . . . . 1.62 109.945 -175.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.611 ' HG2' ' H ' ' A' ' 155' ' ' ASN . 15.5 tt0 179.94 -171.83 0.18 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.509 -1.293 . . . . 4.12 107.509 171.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.611 ' H ' ' HG2' ' A' ' 154' ' ' GLU . 27.8 t-20 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.271 -0.871 . . . . 4.01 109.974 -177.987 . . . . . . . . 1 1 . 1 stop_ save_